{"meta":{"page":1,"per_page":50,"max_per_page":100,"total":96,"total_is_capped":false,"direct_labels_cover":0,"predictions_cover":96,"direct_label_status":"direct model label, unvalidated","prediction_status":"machine_predicted_unvalidated (Codex and Gemma teacher distillation)","score_status":"score_only:v0-immature-baseline (scores rank; they never assert a category)","snapshot":{"source":"OpenAlex, pinned release, all 482 partitions","release":"2026-06-24","frame_built":"2026-07-12","author_layer_release":"2026-06-26"},"query_hash":"d2c2fbed68f4","filters":{"topic":"Synthesis and Reactivity of Heterocycles"}},"results":[{"id":"W2083159984","doi":"10.1021/ar900229z","title":"Meldrum’s Acids and 5-Alkylidene Meldrum’s Acids in Catalytic Carbon−Carbon Bond-Forming Processes","year":2009,"lang":"en","type":"article","venue":"Accounts of Chemical Research","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":172,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Waterloo","funders":"","keywords":"Meldrum's acid; Catalysis; Carbon fibers; Chemistry; Carbon–carbon bond; Organic chemistry; Materials science","authors":[{"name":"Aaron M. Dumas","is_ca":true},{"name":"Éric Fillion","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.0348569248069048,"gpt":0.3271811327914743,"spread":0.2923242079845695,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00031702,0.0004164121,0.0001879212,0.0002751052,0.0001797412,0.000277984,0.0003819478,0.0003726501,0.001284212],"category_scores_gemma":[0.000134553,0.0001703585,0.0002718522,0.0003016922,0.0003031971,0.0005223047,0.0004378467,0.0004936348,0.0006438387],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003554273,"about_ca_system_score_gemma":0.0002053565,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004809253,"about_ca_topic_score_gemma":0.00102705,"domain_scores_codex":[0.9998385,0.00003213879,0.00001333724,0.00003001804,0.0000300033,0.00005598741],"domain_scores_gemma":[0.9999422,0.000009818492,0.00001627917,0.000008838568,0.00000952428,0.00001326275],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00007926484,0.00006293154,0.000215473,0.0002729979,0.00001542977,0.0002914641,0.0001952405,0.0008903427,0.9770892,0.007715478,0.0002247825,0.01294739],"study_design_scores_gemma":[0.00002473885,0.00039744,0.0005477523,0.00001404177,0.00001933987,0.0002826051,0.00003718661,0.001365587,0.9767626,0.0003621917,0.02017056,0.00001598034],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9088735,0.02402483,0.03617826,0.0003992892,0.0002105537,0.0001689005,0.0002175729,0.0003592306,0.02956783],"genre_scores_gemma":[0.9771556,0.007577162,0.01070773,0.00008112252,0.00003386179,0.00004801329,0.0001103629,0.00002277129,0.004263404],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001284212,"threshold_uncertainty_score":0.004296124,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2195669154","doi":"10.1021/acs.orglett.5b02741","title":"Condensation-Driven Assembly of Boron-Containing Bis(Heteroaryl) Motifs Using a Linchpin Approach","year":2015,"lang":"en","type":"article","venue":"Organic Letters","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":87,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Ontario Institute for Cancer Research; University of Toronto","funders":"Natural Sciences and Engineering Research Council of Canada; Ontario Institute for Cancer Research; Canada Foundation for Innovation; Government of Ontario","keywords":"Indolizine; Chemistry; Reagent; Pyridine; Condensation; Combinatorial chemistry; Boron; Thermal stability; Condensation reaction; Block (permutation group theory); Organic chemistry; Catalysis","authors":[{"name":"Shinya Adachi","is_ca":true},{"name":"Sean K. Liew","is_ca":true},{"name":"C. Frank Lee","is_ca":true},{"name":"Alan J. Lough","is_ca":true},{"name":"Zhi He","is_ca":true},{"name":"Jeffrey D. St. Denis","is_ca":true},{"name":"Gennady Poda","is_ca":true},{"name":"Andrei K. Yudin","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.04240431740286901,"gpt":0.2468664002338984,"spread":0.2044620828310294,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001114319,0.0002962699,0.0001498181,0.0001464695,0.0001379466,0.0002062574,0.0002341861,0.0002139551,0.001002059],"category_scores_gemma":[0.00008346229,0.0001375549,0.0001310668,0.00009505946,0.0001521446,0.0002284646,0.0002110182,0.0003663544,0.0005134796],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003110541,"about_ca_system_score_gemma":0.0001672866,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004064371,"about_ca_topic_score_gemma":0.001289288,"domain_scores_codex":[0.999911,0.000013192,0.000006717486,0.00002405877,0.00002343035,0.00002159534],"domain_scores_gemma":[0.999954,0.00000524871,0.0000197069,0.000004493726,0.000004692116,0.0000120019],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00003566679,0.00001653454,0.00006553629,0.00003949607,0.000005657914,0.00005958242,0.0000225223,0.0001624133,0.9948231,0.0006397676,0.00007514654,0.004054529],"study_design_scores_gemma":[0.00001274294,0.0001738511,0.0003210859,0.000003067425,0.000006488797,0.0001396559,0.000006553869,0.0009140301,0.9931906,0.00005978915,0.005164884,0.000007181889],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.908363,0.00354293,0.0710103,0.000242712,0.00009097456,0.0002252022,0.0003423313,0.0006919752,0.01549049],"genre_scores_gemma":[0.9672513,0.001130918,0.0267969,0.00009065934,0.00002085241,0.00007051405,0.0001751741,0.00005566223,0.004407946],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001002059,"threshold_uncertainty_score":0.003352284,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2032731398","doi":"10.1007/s10973-008-9881-6","title":"[1]Benzofuro[3,2-c]pyridine synthesis and coordination reactions","year":2009,"lang":"en","type":"article","venue":"Journal of Thermal Analysis and Calorimetry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":73,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Toronto; University of New Brunswick","funders":"","keywords":"Chemistry; Pyridine; Medicinal chemistry; Acetic acid; Benzoyl chloride; Diphenyl ether; Thermal stability; Inorganic chemistry; Nuclear chemistry; Organic chemistry","authors":[{"name":"S. C. Mojumdar","is_ca":true},{"name":"Peter Šimon","is_ca":false},{"name":"Alžbeta Krutošı́ková","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.009061586339484342,"gpt":0.2340069080865823,"spread":0.224945321747098,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002315753,0.0003545345,0.0004669329,0.0003509501,0.0007176799,0.000207001,0.000684305,0.0003153154,0.003756513],"category_scores_gemma":[0.0002404543,0.0002385588,0.0001250305,0.0006602968,0.0002996772,0.0003078035,0.0003028408,0.0005339928,0.001174668],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0006209444,"about_ca_system_score_gemma":0.0006309424,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.002135847,"about_ca_topic_score_gemma":0.00465589,"domain_scores_codex":[0.9997819,0.00004248857,0.0000126996,0.00004418273,0.00007039442,0.00004820835],"domain_scores_gemma":[0.9999347,0.000008298001,0.00001211877,0.00001698329,0.00001489038,0.0000129881],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0003714024,0.0001211496,0.0002956893,0.0009909772,0.00002676187,0.0004995064,0.0003286235,0.002422553,0.9280804,0.01582959,0.004222098,0.04681123],"study_design_scores_gemma":[0.00007442857,0.0004833426,0.001663576,0.0000359581,0.00002471757,0.001027185,0.00004235013,0.00148787,0.9215085,0.001046423,0.07256342,0.00004224544],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.7178963,0.02623333,0.1420982,0.001218855,0.0007477618,0.001582373,0.005635993,0.001743727,0.1028434],"genre_scores_gemma":[0.916982,0.01000228,0.05352953,0.000241922,0.000124201,0.0006539685,0.001559653,0.0001287685,0.01677778],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003756513,"threshold_uncertainty_score":0.0125668,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2500524559","doi":"10.1080/13543776.2016.1216545","title":"Therapeutic significance of quinolines: a patent review (2013-2015)","year":2016,"lang":"en","type":"review","venue":"Expert Opinion on Therapeutic Patents","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":68,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Saskatchewan","funders":"","keywords":"Quinoline; Pharmacophore; Antimicrobial; Broad spectrum; Combinatorial chemistry; Chemistry; Pharmacology; Medicine; Computational biology; Biology; Bioinformatics; Organic chemistry","authors":[{"name":"S.M. Ali Hussaini","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.1785058521527395,"gpt":0.3792114764262831,"spread":0.2007056242735437,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0004276765,0.0006907584,0.000815973,0.00262702,0.0002870037,0.0009950873,0.0006344171,0.0007396166,0.01005551],"category_scores_gemma":[0.0006212196,0.000228608,0.0006252489,0.002378316,0.0002849784,0.001105924,0.0004958797,0.001189212,0.003260745],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0006434078,"about_ca_system_score_gemma":0.00113758,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0009026814,"about_ca_topic_score_gemma":0.002084689,"domain_scores_codex":[0.9998456,0.00001637504,0.00001716697,0.00002882791,0.00006650302,0.00002546011],"domain_scores_gemma":[0.9997881,0.0000639375,0.00005372076,0.000005788842,0.00006530958,0.0000230803],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"design_other","study_design_gemma":"not_applicable","study_design_scores_codex":[0.00008488065,0.0000709176,0.0001441899,0.01604841,0.00007114623,0.0004968888,0.00006806862,0.0003910107,0.003942413,0.00469307,0.02989722,0.9440918],"study_design_scores_gemma":[0.00002443893,0.0001346665,0.0008155743,0.003408039,0.0001380064,0.001390642,0.00004808605,0.0001013161,0.001242528,0.001201932,0.9914783,0.00001650186],"study_design_candidate":"not_applicable","study_design_consensus":null,"genre_codex":"review","genre_gemma":"review","genre_scores_codex":[0.0008480558,0.9906584,0.0003852829,0.0007046736,0.0003716689,0.00003530057,0.0001576911,0.00002440745,0.006814457],"genre_scores_gemma":[0.0044353,0.9917024,0.0003908813,0.0003812773,0.0002010375,0.00002032441,0.0001592406,0.00000390421,0.002705661],"genre_candidate":"review","genre_consensus":"review","teacher_disagreement_score":0.01005551,"threshold_uncertainty_score":0.03363901,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2156708935","doi":"10.1002/adsc.200600298","title":"Synthesis of Indolizines and Benzoindolizines by Annulation of Donor‐Acceptor Cyclopropanes with Electron‐Deficient Pyridines and Quinolines","year":2006,"lang":"en","type":"article","venue":"Advanced Synthesis & Catalysis","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":62,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Western University","funders":"American Chemical Society Petroleum Research Fund","keywords":"Annulation; Chemistry; Pyridine; Autoxidation; Electron acceptor; Cycloaddition; Medicinal chemistry; Electron; Electron donor; Photochemistry; Stereochemistry; Organic chemistry; Catalysis","authors":[{"name":"Nicholas A. Morra","is_ca":true},{"name":"Christian L. Morales","is_ca":true},{"name":"Barbora Bajtos","is_ca":true},{"name":"Xin Wang","is_ca":true},{"name":"Hyosook Jang","is_ca":true},{"name":"Jian Wang","is_ca":true},{"name":"Ming Yu","is_ca":true},{"name":"Brian L. Pagenkopf","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.003279809181436782,"gpt":0.1974215994552726,"spread":0.1941417902738359,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001235009,0.000235037,0.0001530632,0.0001755336,0.0001134581,0.0001738777,0.0002353081,0.0001294653,0.002427648],"category_scores_gemma":[0.0001037862,0.0001307315,0.0001443642,0.0001292087,0.0001577148,0.0001992914,0.000190129,0.0002606801,0.0005679273],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001962184,"about_ca_system_score_gemma":0.000194222,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001990058,"about_ca_topic_score_gemma":0.0005139474,"domain_scores_codex":[0.9999516,0.000006871009,0.000003722072,0.000007458594,0.00001308136,0.0000172532],"domain_scores_gemma":[0.9999677,0.00000461346,0.000008774937,0.000005035665,0.000004314044,0.000009527458],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0001143547,0.00006223309,0.0001608611,0.0001923351,0.00001623258,0.0002538295,0.00009651387,0.0009931555,0.9754964,0.007791221,0.0002406448,0.01458216],"study_design_scores_gemma":[0.00008524589,0.0005854371,0.001591636,0.00001423789,0.00001944055,0.0004395965,0.00002541074,0.001162497,0.9757892,0.000912026,0.01935508,0.00002016401],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9557911,0.003844835,0.01476445,0.0001966173,0.00009192172,0.0001526236,0.0004512532,0.0001876638,0.02451952],"genre_scores_gemma":[0.9860057,0.002251684,0.00589021,0.00004070361,0.00001288849,0.00004246836,0.0002183513,0.00002350879,0.005514431],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002427648,"threshold_uncertainty_score":0.008121252,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2058073539","doi":"10.1021/ol901264f","title":"Intramolecular Pyridine Activation−Dearomatization Reaction: Highly Stereoselective Synthesis of Polysubstituted Indolizidines and Quinolizidines","year":2009,"lang":"en","type":"article","venue":"Organic Letters","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":58,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Université de Montréal","funders":"","keywords":"Chemistry; Stereoselectivity; Intramolecular force; Pyridine; Stereochemistry; Organic chemistry; Combinatorial chemistry; Catalysis","authors":[{"name":"Guillaume Barbe","is_ca":true},{"name":"Guillaume Pelletier","is_ca":true},{"name":"André B. Charette","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.006780460628098005,"gpt":0.2000909764018864,"spread":0.1933105157737884,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001309306,0.0004825787,0.0001962195,0.0001568306,0.0001928605,0.000166894,0.0004130091,0.0001858667,0.001771331],"category_scores_gemma":[0.00007646693,0.0001135693,0.0001592863,0.0001330153,0.0001734952,0.0002859091,0.0002498106,0.0004329252,0.0006445515],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002117315,"about_ca_system_score_gemma":0.0002435598,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003238212,"about_ca_topic_score_gemma":0.0008533945,"domain_scores_codex":[0.9999076,0.000009962746,0.000007227917,0.00002398039,0.0000254242,0.00002580352],"domain_scores_gemma":[0.9999751,0.000003464716,0.000007294135,0.000004835117,0.000003669516,0.000005676969],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00005798593,0.00004448412,0.0001458852,0.00009800475,0.00001000932,0.0003204195,0.00007848309,0.0003442047,0.9833853,0.001175125,0.0001436262,0.01419647],"study_design_scores_gemma":[0.00002275179,0.000328492,0.0008327307,0.000004316179,0.00001410997,0.0007559204,0.00001602111,0.0006695893,0.9893757,0.0001501895,0.007819506,0.00001068159],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9249096,0.005530656,0.04151968,0.0002224929,0.0001192851,0.0001754698,0.0004230469,0.0003828738,0.02671694],"genre_scores_gemma":[0.9840429,0.001926978,0.00861268,0.00004206329,0.00002282638,0.00004324603,0.0002289572,0.00003003566,0.0050502],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001771331,"threshold_uncertainty_score":0.005925715,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2204552266","doi":"10.1021/acs.orglett.5b02220","title":"Synthesis of Indolizine Derivatives by Pd-Catalyzed Oxidative Carbonylation","year":2015,"lang":"en","type":"article","venue":"Organic Letters","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":57,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Ottawa","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Indolizine; Chemistry; Carbonylation; Catalysis; Palladium; Oxidative phosphorylation; Oxidative addition; Organic chemistry; Combinatorial chemistry; Medicinal chemistry; Carbon monoxide","authors":[{"name":"Tongyu Xu","is_ca":true},{"name":"Howard Alper","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01482761910494842,"gpt":0.2190513723807743,"spread":0.2042237532758259,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001153804,0.0004281176,0.0002985695,0.0002862135,0.000169122,0.0001843193,0.0005419168,0.0002891212,0.001734325],"category_scores_gemma":[0.000102421,0.0001830178,0.0002337334,0.000323189,0.0001734376,0.0002802911,0.0002753739,0.0005270151,0.0006895705],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002714076,"about_ca_system_score_gemma":0.0002646526,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004724381,"about_ca_topic_score_gemma":0.001062333,"domain_scores_codex":[0.9999062,0.000010585,0.00000829642,0.00001507034,0.00002866139,0.00003115559],"domain_scores_gemma":[0.999961,0.000003310829,0.000009335859,0.000005534548,0.000008302209,0.00001251054],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00009959707,0.00007791674,0.0001360743,0.0003009571,0.00003230213,0.0004327777,0.00007845987,0.0009074286,0.9819213,0.001907264,0.000404755,0.0137011],"study_design_scores_gemma":[0.00004301261,0.000451947,0.0006616535,0.000009839822,0.00002787929,0.0002693338,0.00001119965,0.0007929557,0.9872916,0.0001263914,0.01029232,0.00002184047],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9404159,0.00824654,0.02638483,0.0003504062,0.0001891751,0.0003366931,0.001259226,0.000472971,0.0223444],"genre_scores_gemma":[0.9803154,0.00449167,0.009423447,0.00007041766,0.00001948239,0.00009453348,0.0006131828,0.0000339904,0.004937846],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001734325,"threshold_uncertainty_score":0.005801857,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2102227937","doi":"10.1002/cmdc.200800050","title":"Nonpeptidic Vinyl and Allyl Phosphonates as Falcipain‐2 Inhibitors","year":2008,"lang":"en","type":"article","venue":"ChemMedChem","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":46,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"","funders":"Indigenous and Northern Affairs Canada","keywords":"Cysteine protease; Cysteine; Chemistry; Stereochemistry; Enzyme; Protease; Enzyme inhibitor; Combinatorial chemistry; Biochemistry","authors":[{"name":"Roberta Ettari","is_ca":false},{"name":"Emanuela Nizi","is_ca":false},{"name":"Maria Emilia Di Francesco","is_ca":false},{"name":"Nicola Micale","is_ca":false},{"name":"Silvana Grasso","is_ca":false},{"name":"Maria Zappalà","is_ca":false},{"name":"Radim Vičík","is_ca":false},{"name":"Tanja Schirmeister","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01342293086868059,"gpt":0.2100451813010931,"spread":0.1966222504324125,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002227455,0.0003545806,0.0003360321,0.0001653676,0.0001100506,0.0002466189,0.0003054651,0.0002864428,0.001151248],"category_scores_gemma":[0.0001671163,0.00010447,0.0001468071,0.0001860788,0.0001753541,0.0002680544,0.0001497536,0.000283937,0.0002131298],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002603137,"about_ca_system_score_gemma":0.0002075199,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004809404,"about_ca_topic_score_gemma":0.001203667,"domain_scores_codex":[0.9998485,0.00004391119,0.00001105819,0.00002842857,0.00003751269,0.00003051785],"domain_scores_gemma":[0.9999305,0.00002084271,0.00001714673,0.000007476418,0.00001045989,0.00001351382],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0003200453,0.00008237837,0.0002231725,0.0001639012,0.00001538849,0.0001130801,0.00002994739,0.0004422901,0.9922668,0.0004106997,0.00005693219,0.00587532],"study_design_scores_gemma":[0.00008052828,0.002043056,0.001356596,0.000008776917,0.00002006728,0.0002753666,0.00001920836,0.0007191164,0.9919243,0.00007811293,0.00346547,0.000009334412],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9882746,0.00692146,0.001616785,0.00006425576,0.00003175326,0.00006254589,0.0001897144,0.00001903043,0.002819761],"genre_scores_gemma":[0.9906574,0.004045489,0.002235682,0.00004533639,0.00001868735,0.00003504454,0.0002272244,0.00001149662,0.002723623],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001151248,"threshold_uncertainty_score":0.003851235,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2328283615","doi":"10.1021/acs.orglett.5b00994","title":"One-Pot Synthesis of Brightly Fluorescent Mes<sub>2</sub>B-Functionalized Indolizine Derivatives via Cycloaddition Reactions","year":2015,"lang":"en","type":"article","venue":"Organic Letters","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":42,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Queen's University","funders":"Natural Sciences and Engineering Research Council of Canada; Studienstiftung des Deutschen Volkes; Evangelisches Studienwerk Villigst","keywords":"Indolizine; Chemistry; Cycloaddition; Delocalized electron; Isoindole; Lone pair; Fluorescence; HOMO/LUMO; Pyridine; Stereochemistry; Photochemistry; Medicinal chemistry; Molecule; Organic chemistry; Catalysis","authors":[{"name":"Deng‐Tao Yang","is_ca":true},{"name":"Julian Radtke","is_ca":false},{"name":"Soren K. Mellerup","is_ca":true},{"name":"Kang Yuan","is_ca":true},{"name":"Xiang Wang","is_ca":true},{"name":"Matthias Wagner","is_ca":false},{"name":"Suning Wang","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01849614350711143,"gpt":0.2130126746058532,"spread":0.1945165310987418,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00007542695,0.0003901595,0.000229436,0.0001831579,0.0001367682,0.0001744096,0.0003338502,0.0002308415,0.001901357],"category_scores_gemma":[0.00007466936,0.0001443793,0.0001553151,0.0001992445,0.0001403983,0.0002242104,0.0002002472,0.000355193,0.0005411565],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002432034,"about_ca_system_score_gemma":0.0001522061,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004817499,"about_ca_topic_score_gemma":0.001130836,"domain_scores_codex":[0.999948,0.000006907,0.000004495684,0.00001167807,0.00001117044,0.00001765767],"domain_scores_gemma":[0.999967,0.000004833686,0.0000105011,0.000003482543,0.000005057588,0.000009251025],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00007815546,0.00005523362,0.00009932149,0.0001543144,0.00001673227,0.0001824387,0.00004917098,0.0006064428,0.9897186,0.001135398,0.0002764005,0.007627905],"study_design_scores_gemma":[0.00002666304,0.0002687669,0.0006662821,0.000004541334,0.00001447093,0.0001900971,0.00001203002,0.0007545716,0.9926593,0.00007953073,0.005311229,0.00001272051],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9617335,0.002370057,0.01755305,0.000176763,0.00007558363,0.0002200498,0.0006163049,0.0003735455,0.01688118],"genre_scores_gemma":[0.9837258,0.001520397,0.01030836,0.0000610398,0.000008556669,0.00008810192,0.0002292559,0.00002785182,0.004030606],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001901357,"threshold_uncertainty_score":0.00636065,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2609426384","doi":"10.1021/acs.joc.6b02928","title":"General C–H Arylation Strategy for the Synthesis of Tunable Visible Light-Emitting Benzo[<i>a</i>]imidazo[2,1,5-<i>c</i>,<i>d</i>]indolizine Fluorophores","year":2017,"lang":"en","type":"article","venue":"The Journal of Organic Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":38,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Université de Montréal; Centre in Green Chemistry and Catalysis","funders":"Fonds de recherche du Québec – Nature et technologies; Université de Montréal; Natural Sciences and Engineering Research Council of Canada; Canada Research Chairs; Canada Foundation for Innovation","keywords":"Chemistry; Indolizine; Substituent; Fluorescence; Intramolecular force; Density functional theory; Amide; Time-dependent density functional theory; Electrophilic substitution; Electrophile; Combinatorial chemistry; Photochemistry; Stereochemistry; Medicinal chemistry; Computational chemistry; Organic chemistry; Catalysis","authors":[{"name":"Éric Lévesque","is_ca":true},{"name":"William S. Bechara","is_ca":true},{"name":"Léa Constantineau-Forget","is_ca":true},{"name":"Guillaume Pelletier","is_ca":true},{"name":"Natalie M. Rachel","is_ca":true},{"name":"Joelle N. Pelletier","is_ca":true},{"name":"André B. Charette","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.02058848363071931,"gpt":0.2558995902547048,"spread":0.2353111066239855,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001029054,0.0003744785,0.0001512873,0.0001622791,0.0001405521,0.0001137085,0.0002508577,0.0001949518,0.001019922],"category_scores_gemma":[0.0001046288,0.000111996,0.0001439095,0.0001832339,0.0001457027,0.0002336811,0.0001764574,0.0004320372,0.0005079359],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002339247,"about_ca_system_score_gemma":0.0002812047,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004237139,"about_ca_topic_score_gemma":0.001330694,"domain_scores_codex":[0.9999394,0.000007235071,0.00000528388,0.00001582073,0.00001394828,0.00001831011],"domain_scores_gemma":[0.9999666,0.000004984212,0.00001186589,0.000005615038,0.000004943105,0.000005995674],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00005378748,0.00005829824,0.0001274908,0.0001636769,0.00001081043,0.0001509558,0.00004814265,0.0006584912,0.9870322,0.001873169,0.0003168561,0.009506055],"study_design_scores_gemma":[0.00003062786,0.0003473432,0.0009501135,0.00000859215,0.00001974577,0.0003444333,0.00001149355,0.001927953,0.985776,0.0002935776,0.01026929,0.00002078627],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8778598,0.004618865,0.09677283,0.0003815496,0.0001387411,0.0003189358,0.0008044834,0.0005094808,0.01859526],"genre_scores_gemma":[0.9723302,0.002232941,0.02268022,0.00008821005,0.0000211647,0.00008681235,0.0002741705,0.00002909844,0.002257111],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001019922,"threshold_uncertainty_score":0.003412008,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2044306236","doi":"10.1002/ejoc.201001468","title":"Grignard Reactions in Pyridinium and Phosphonium Ionic Liquids","year":2010,"lang":"en","type":"article","venue":"European Journal of Organic Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":34,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Saint Mary's University","funders":"","keywords":"Chemistry; Pyridinium; Phosphonium; Ionic liquid; Grignard reaction; Solvent; Diethyl ether; Organic chemistry; Yield (engineering); Alcohol; Ether; Ionic bonding; Medicinal chemistry; Catalysis; Ion","authors":[{"name":"Leigh Ford","is_ca":false},{"name":"Farzad Atefi","is_ca":false},{"name":"Robert D. Singer","is_ca":true},{"name":"Peter J. Scammells","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.006382835290225517,"gpt":0.1971440523809964,"spread":0.1907612170907708,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0005625498,0.0005315795,0.0003856286,0.0003140761,0.0001452109,0.000229185,0.0003603648,0.0004100924,0.001289777],"category_scores_gemma":[0.0004067722,0.0002187302,0.0002705674,0.0001905119,0.0002962372,0.0004880362,0.0006285806,0.0004764711,0.0004674316],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004028789,"about_ca_system_score_gemma":0.000259009,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004424835,"about_ca_topic_score_gemma":0.001028509,"domain_scores_codex":[0.9995796,0.0001205817,0.00002428811,0.00005992831,0.0001084888,0.0001071474],"domain_scores_gemma":[0.9998631,0.00004488061,0.00003464181,0.00001574929,0.00001914845,0.00002233964],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0002188099,0.00002367988,0.0001107493,0.0001573458,0.00001454288,0.0001628714,0.00008034059,0.0002236716,0.9942033,0.0009573196,0.0000942534,0.003753051],"study_design_scores_gemma":[0.00001331064,0.0001404631,0.0001321246,0.000003642425,0.00000701719,0.00009013073,0.000006581581,0.0002219533,0.9982399,0.00003941788,0.001101662,0.000003820988],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9793774,0.002948447,0.009373391,0.0001592563,0.00006434353,0.00009168769,0.0001003869,0.0002233671,0.007661615],"genre_scores_gemma":[0.9872846,0.001462607,0.0072555,0.0000552182,0.0000135049,0.00004254433,0.0001026281,0.00003362008,0.0037497],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001289777,"threshold_uncertainty_score":0.00431478,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3113884167","doi":"10.1039/d0sc03977b","title":"Palladium catalyzed synthesis of indolizines <i>via</i> the carbonylative coupling of bromopyridines, imines and alkynes","year":2020,"lang":"en","type":"article","venue":"Chemical Science","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":33,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"McGill University","funders":"Fonds de recherche du Québec – Nature et technologies; Fonds Québécois de la Recherche sur la Nature et les Technologies; Canada Foundation for Innovation; Natural Sciences and Engineering Research Council of Canada; McGill University","keywords":"Palladium; Catalysis; Chemistry; Coupling (piping); Carbonylation; Combinatorial chemistry; Organic chemistry; Materials science; Carbon monoxide","authors":[{"name":"Sébastien A. Roy","is_ca":true},{"name":"José Zgheib","is_ca":true},{"name":"Cuihan Zhou","is_ca":true},{"name":"Bruce A. Arndtsen","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01776672354277296,"gpt":0.2278646853411968,"spread":0.2100979617984239,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00009219447,0.0002983766,0.0001482063,0.0001902498,0.0001539766,0.00022938,0.0004701152,0.0002073569,0.001589332],"category_scores_gemma":[0.0001059426,0.0001778079,0.0001311023,0.0001848852,0.0001420855,0.0003055283,0.0003107814,0.0004713422,0.0006083148],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002944458,"about_ca_system_score_gemma":0.0003401273,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003553724,"about_ca_topic_score_gemma":0.001006901,"domain_scores_codex":[0.99993,0.000007083552,0.000005727454,0.00001583861,0.00001959633,0.00002177674],"domain_scores_gemma":[0.9999735,0.00000213576,0.000008486044,0.000004208026,0.000004178107,0.000007509598],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00007201292,0.00006167904,0.0001316608,0.0002328937,0.00001873535,0.0003299532,0.00007810126,0.001216506,0.9739226,0.007085538,0.0006923755,0.01615798],"study_design_scores_gemma":[0.00002650853,0.0003468591,0.0006082965,0.00001228483,0.00001371351,0.0003481662,0.00001526653,0.000914128,0.9779127,0.0003883412,0.01939804,0.00001569247],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8794302,0.005655287,0.05806928,0.0004657858,0.0002134637,0.000290889,0.001240577,0.0008479299,0.05378659],"genre_scores_gemma":[0.9728793,0.003262017,0.01643832,0.00008137877,0.00002475242,0.00008569366,0.0004670194,0.00004776959,0.006713768],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001589332,"threshold_uncertainty_score":0.005316854,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2564695802","doi":"10.1002/anie.201609726","title":"Development and Cycloaddition Reactivity of a New Class of Pyridine‐Based Mesoionic 1,3‐Dipole","year":2016,"lang":"en","type":"article","venue":"Angewandte Chemie International Edition","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":33,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"McGill University","funders":"Fonds de recherche du Québec – Nature et technologies; Natural Sciences and Engineering Research Council of Canada; Centre in Green Chemistry and Catalysis","keywords":"Mesoionic; Pyridine; Cycloaddition; Reactivity (psychology); Quinoline; Chemistry; Dipole; 1,3-Dipolar cycloaddition; Alkyne; Computational chemistry; Combinatorial chemistry; Organic chemistry; Catalysis","authors":[{"name":"Huseyin Erguven","is_ca":true},{"name":"David C. Leitch","is_ca":true},{"name":"Evan N. Keyzer","is_ca":true},{"name":"Bruce A. Arndtsen","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.02168338587044382,"gpt":0.2489007441096701,"spread":0.2272173582392263,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000240422,0.0002148421,0.0001221224,0.0001868652,0.0001206801,0.0002285019,0.0003555825,0.0002356334,0.001024748],"category_scores_gemma":[0.0002786496,0.0001026086,0.0001426178,0.0001129997,0.0002417877,0.0002644195,0.0002374892,0.0004999292,0.0002825708],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003130301,"about_ca_system_score_gemma":0.0001850826,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003527924,"about_ca_topic_score_gemma":0.000486358,"domain_scores_codex":[0.9998888,0.00001316049,0.00000582031,0.00002071466,0.00004618192,0.00002532907],"domain_scores_gemma":[0.9998791,0.00002423665,0.00003662359,0.00001924278,0.00001840226,0.0000224074],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00005832319,0.0000406176,0.0002508357,0.00008799798,0.000007008859,0.0001108829,0.00005406502,0.0005769849,0.9896438,0.001607768,0.0001282745,0.007433527],"study_design_scores_gemma":[0.00001274452,0.0003440057,0.0006760148,0.000004384665,0.000006414192,0.0002737505,0.00001228869,0.0008077653,0.9920546,0.0001258207,0.005672195,0.00001007373],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9668822,0.003348585,0.01749438,0.0002032421,0.00004808465,0.0001461209,0.0002641193,0.0001576785,0.01145557],"genre_scores_gemma":[0.9911678,0.001238076,0.005697021,0.0000414736,0.000009536398,0.00003698577,0.0001725585,0.00001378658,0.001622794],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001024748,"threshold_uncertainty_score":0.003428161,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2029861563","doi":"10.1016/j.bmcl.2008.03.077","title":"Synthesis and PKCθ inhibitory activity of a series of 4-(indol-5-ylamino)thieno[2,3-b]pyridine-5-carbonitriles","year":2008,"lang":"en","type":"article","venue":"Bioorganic & Medicinal Chemistry Letters","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":33,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Women's Health Research Institute","funders":"","keywords":"Pyridine; Chemistry; Inhibitory postsynaptic potential; Stereochemistry; Bicyclic molecule; Medicinal chemistry; Internal medicine; Medicine","authors":[{"name":"Diane H. Boschelli","is_ca":true},{"name":"Biqi Wu","is_ca":false},{"name":"Ana Carolina Barrios Sosa","is_ca":false},{"name":"Joan Chen","is_ca":false},{"name":"Magda Asselin","is_ca":false},{"name":"Derek C. Cole","is_ca":false},{"name":"Julie Lee","is_ca":false},{"name":"Xiaoke Yang","is_ca":false},{"name":"Divya Chaudhary","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01449060384949189,"gpt":0.1958223986736673,"spread":0.1813317948241754,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001779744,0.000381901,0.0002591464,0.0003573943,0.000265068,0.0001830125,0.0004029434,0.0002803518,0.00233363],"category_scores_gemma":[0.0001501002,0.0001519085,0.0002021321,0.0002101631,0.0001761462,0.0001932283,0.0001980282,0.0004044356,0.0004571026],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002468266,"about_ca_system_score_gemma":0.0004116799,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0007798381,"about_ca_topic_score_gemma":0.001647211,"domain_scores_codex":[0.9999139,0.00001547718,0.000008939331,0.0000140315,0.00001878399,0.00002882862],"domain_scores_gemma":[0.9999242,0.00001087647,0.00002075087,0.0000100975,0.00001055353,0.00002343112],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0004767853,0.0002015973,0.0002273311,0.0002851531,0.00002225926,0.0004955814,0.00007986483,0.00150475,0.9775993,0.001181192,0.0004404013,0.01748582],"study_design_scores_gemma":[0.0001637572,0.003807134,0.002804753,0.00003667091,0.00005657881,0.0008039635,0.00004125625,0.001204811,0.9798514,0.0001540614,0.01104436,0.00003127984],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9703179,0.00977043,0.005875982,0.0002044615,0.0001085043,0.0002385171,0.0007157008,0.0001675123,0.01260094],"genre_scores_gemma":[0.9809467,0.007750105,0.004250769,0.00009464526,0.00005047564,0.000170277,0.0008918401,0.00001903027,0.005826031],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.00233363,"threshold_uncertainty_score":0.007806778,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2969511024","doi":"10.1039/c9cc04730a","title":"Synthesis of a crystallochromic indolizine dye by a base- and catalyst-free photochemical route","year":2019,"lang":"en","type":"article","venue":"Chemical Communications","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":31,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Vancouver Biotech (Canada); University of British Columbia","funders":"Deutsche Forschungsgemeinschaft","keywords":"Indolizine; Chemistry; Substituent; Catalysis; Acetylene; Base (topology); Photochemistry; Organic chemistry","authors":[{"name":"Christoph Dohmen","is_ca":false},{"name":"Heiko Ihmels","is_ca":false},{"name":"Rouven Kreienmeier","is_ca":false},{"name":"Brian O. Patrick","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01274004915381265,"gpt":0.2324568299901809,"spread":0.2197167808363682,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00007805556,0.0002709471,0.0002964858,0.000265159,0.0001622097,0.0002213244,0.0003763377,0.0003735285,0.002234061],"category_scores_gemma":[0.0001162269,0.0001455349,0.0001595307,0.0002819018,0.0002168234,0.0002277417,0.0002419498,0.0006298504,0.0008914932],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003292983,"about_ca_system_score_gemma":0.0003153464,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0007219686,"about_ca_topic_score_gemma":0.001212752,"domain_scores_codex":[0.9999192,0.00000693935,0.00000346294,0.00001932338,0.00002672702,0.00002434233],"domain_scores_gemma":[0.9999434,0.000009730044,0.00001042866,0.00001150264,0.000009773156,0.00001526286],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00002798243,0.00001895322,0.00003699599,0.00007088191,0.000004262778,0.00007872601,0.00002111541,0.0001537571,0.9948838,0.001110374,0.0001266174,0.003466402],"study_design_scores_gemma":[0.00002098819,0.0001702085,0.0004688627,0.000004952965,0.000007329878,0.0001802368,0.000006576661,0.0004977551,0.9920123,0.00008685346,0.006533041,0.00001086706],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9277912,0.003008284,0.04337919,0.0003706299,0.0001889527,0.0002681311,0.001199441,0.0006090109,0.02318518],"genre_scores_gemma":[0.9692248,0.001941564,0.02172298,0.00006910814,0.00002300499,0.0001080003,0.000456305,0.00009207553,0.006362243],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002234061,"threshold_uncertainty_score":0.007473707,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2031988080","doi":"10.1016/j.tetlet.2011.01.087","title":"One-pot multistep synthesis of 3-aminoindolizine derivatives","year":2011,"lang":"en","type":"article","venue":"Tetrahedron Letters","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":25,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Merck Canada Inc. (Canada)","funders":"","keywords":"Chemistry; Hydride; Combinatorial chemistry; Sequence (biology); One-pot synthesis; Scope (computer science); Reaction conditions; Organic chemistry; Catalysis; Hydrogen","authors":[{"name":"Lianhai Li","is_ca":true},{"name":"Waepril Kimberly S. Chua","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.04151346717552281,"gpt":0.2264806900653192,"spread":0.1849672228897964,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002279398,0.0003736891,0.0003583728,0.0002967182,0.0002541976,0.0002145287,0.0006924932,0.0003395764,0.002256363],"category_scores_gemma":[0.0001491517,0.000171319,0.0002351937,0.0002311405,0.0001895173,0.0003067817,0.0003920539,0.0006041681,0.0007232712],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004043778,"about_ca_system_score_gemma":0.0003755766,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004287027,"about_ca_topic_score_gemma":0.001197135,"domain_scores_codex":[0.9998503,0.00002109724,0.0000132594,0.00002375434,0.00003572151,0.00005591918],"domain_scores_gemma":[0.9999403,0.000009765971,0.0000142521,0.000009331081,0.00000982832,0.00001650066],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0002111955,0.0001778493,0.0001821734,0.0002724064,0.0000310348,0.0006782953,0.0002557889,0.001386435,0.9698344,0.005832965,0.0007290806,0.02040847],"study_design_scores_gemma":[0.00005450521,0.0005790247,0.0009252035,0.00001282754,0.00002339273,0.0004559393,0.00002843062,0.001335569,0.9819822,0.000432124,0.0141414,0.00002926602],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9184186,0.004548179,0.04057066,0.0004604617,0.0002218038,0.0003190851,0.0007467377,0.000516491,0.03419786],"genre_scores_gemma":[0.977284,0.001717827,0.01138102,0.00009498519,0.000016993,0.0001055492,0.0002275553,0.00004780284,0.009124316],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002256363,"threshold_uncertainty_score":0.007548273,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2520823756","doi":"10.1039/c6dt90140a","title":"Small molecule activation","year":2016,"lang":"en","type":"editorial","venue":"Dalton Transactions","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":24,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Canadian Nautical Research Society","funders":"","keywords":"Molecule; Small molecule; Chemistry; Organic chemistry; Biochemistry","authors":[{"name":"Bárbara Milani","is_ca":false},{"name":"Giulia Licini","is_ca":false},{"name":"Eric Clot","is_ca":true},{"name":"Martin Albrecht","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01454117040103035,"gpt":0.2414031858432931,"spread":0.2268620154422627,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.002143781,0.00186916,0.001139349,0.0009501025,0.001077603,0.002811313,0.001928537,0.004850238,0.03515739],"category_scores_gemma":[0.004698593,0.0006618683,0.000883766,0.0005409198,0.001033548,0.003580299,0.001647944,0.008501361,0.01905218],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001183749,"about_ca_system_score_gemma":0.001498051,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002233295,"about_ca_topic_score_gemma":0.0007180637,"domain_scores_codex":[0.9979143,0.0002643938,0.0001491822,0.0002883311,0.001172206,0.0002115963],"domain_scores_gemma":[0.998009,0.000527541,0.0001726531,0.00008967644,0.0007233707,0.0004778219],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"not_applicable","study_design_gemma":"not_applicable","study_design_scores_codex":[0.00007451447,0.00001821711,0.00001057943,0.0005217405,0.00001501056,0.00007864999,0.00001465691,0.00003980219,0.002122335,0.002494116,0.9710072,0.02360316],"study_design_scores_gemma":[0.00001718017,0.00002833642,0.00002095155,0.00003814464,0.00000603407,0.00005431087,0.000005075356,0.00003280256,0.0009492875,0.0005531514,0.9982892,0.00000554693],"study_design_candidate":"not_applicable","study_design_consensus":"not_applicable","genre_codex":"editorial","genre_gemma":"editorial","genre_scores_codex":[0.0001890777,0.03422087,0.0008102392,0.02202708,0.9327608,0.00005035082,0.0001162072,0.0001593378,0.009666007],"genre_scores_gemma":[0.005751875,0.07538764,0.001241457,0.04230326,0.6727741,0.0001645147,0.0003822747,0.0002979209,0.2016969],"genre_candidate":"editorial","genre_consensus":"editorial","teacher_disagreement_score":0.03515739,"threshold_uncertainty_score":0.1176131,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2155007609","doi":"10.1039/c3mt00135k","title":"3-Hydroxy-4-pyridinone derivatives as metal ion and amyloid binding agents","year":2013,"lang":"en","type":"article","venue":"Metallomics","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":23,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"University of British Columbia","funders":"Canadian Institutes of Health Research","keywords":"Chemistry; Amyloid (mycology); Metal; Metal ions in aqueous solution; Combinatorial chemistry; Organic chemistry; Inorganic chemistry","authors":[{"name":"Maria A. Telpoukhovskaia","is_ca":true},{"name":"Cristina Rodríguez‐Rodríguez","is_ca":true},{"name":"Jacqueline F. Cawthray","is_ca":true},{"name":"Lauren E. Scott","is_ca":true},{"name":"Brent D. G. Page","is_ca":true},{"name":"Jorge Alí‐Torres","is_ca":false},{"name":"Mariona Sodupe","is_ca":false},{"name":"Gwendolyn A. Bailey","is_ca":true},{"name":"Brian O. Patrick","is_ca":true},{"name":"Chris Orvig","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01943241337225278,"gpt":0.2373900112243243,"spread":0.2179575978520715,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001122735,0.0002559251,0.000174868,0.000123545,0.0001024091,0.0001386991,0.0002654453,0.0001920668,0.000954242],"category_scores_gemma":[0.0001037322,0.0001079256,0.00009891211,0.0001454449,0.0001559389,0.0001356014,0.0001529177,0.0001883893,0.000309351],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001727553,"about_ca_system_score_gemma":0.0001183114,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003768338,"about_ca_topic_score_gemma":0.0009626716,"domain_scores_codex":[0.9999193,0.00002183833,0.00000517679,0.0000143138,0.00001873825,0.00002070341],"domain_scores_gemma":[0.9999352,0.00001265507,0.000020858,0.000007241515,0.000008294477,0.00001576163],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0001331395,0.00004523329,0.0001680502,0.0001463081,0.000005521501,0.00009995035,0.00003397278,0.0007544137,0.9935856,0.0002943762,0.00006871518,0.004664613],"study_design_scores_gemma":[0.00004374951,0.0008533883,0.001316266,0.000008008492,0.0000117528,0.0002145583,0.00002363242,0.0008395109,0.9904068,0.00006128661,0.006209722,0.00001121185],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9866284,0.004246127,0.005800467,0.00009254347,0.00002164119,0.00006483141,0.0001640722,0.0001010637,0.00288087],"genre_scores_gemma":[0.9896645,0.001784515,0.006016367,0.00004639587,0.000008169543,0.0000443578,0.0001143419,0.00001108379,0.00231032],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.000954242,"threshold_uncertainty_score":0.003192246,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2114860602","doi":"10.1002/adsc.201100795","title":"Synthesis of Functionalized Indolizines by Lewis Acid‐Mediated Cyclocondensation of 3‐(Pyridin‐2‐yl)‐propiolates with Enones","year":2012,"lang":"en","type":"article","venue":"Advanced Synthesis & Catalysis","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":22,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Queen's University","funders":"","keywords":"Chemistry; Indolizine; Regioselectivity; Lewis acids and bases; Combinatorial chemistry; Lewis acid catalysis; Catalysis; Organic chemistry; Medicinal chemistry","authors":[{"name":"Verena Specowius","is_ca":false},{"name":"Franziska Bendrath","is_ca":false},{"name":"Marleen Winterberg","is_ca":false},{"name":"Khurshid Ayub","is_ca":true},{"name":"Peter Langer","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.007862881936019526,"gpt":0.2146083151614419,"spread":0.2067454332254224,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00009799834,0.0003581461,0.0001966882,0.000215373,0.0001253852,0.0001738298,0.0002809054,0.0002082537,0.002021712],"category_scores_gemma":[0.0001191502,0.0001374484,0.0001782908,0.0001458279,0.0001608586,0.0002273092,0.0001917524,0.0003347726,0.0005152677],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002330018,"about_ca_system_score_gemma":0.0002300312,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003555742,"about_ca_topic_score_gemma":0.001101661,"domain_scores_codex":[0.9999422,0.000007122935,0.000004575774,0.000009323004,0.00001305521,0.00002370183],"domain_scores_gemma":[0.9999585,0.000007197564,0.00001162339,0.000005110373,0.000006287089,0.00001119355],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0001815208,0.00004712427,0.0001571488,0.0001708323,0.00002107825,0.0003843852,0.00009832376,0.001377865,0.9883963,0.002016401,0.0001802716,0.006968589],"study_design_scores_gemma":[0.0000416583,0.0002938269,0.0005667518,0.000006158532,0.0000123307,0.00009578124,0.00001673022,0.0009487586,0.9941228,0.0001258017,0.003757256,0.00001214391],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9812432,0.001523608,0.008009428,0.0001066768,0.00007510791,0.0001201355,0.000353464,0.0001128482,0.008455561],"genre_scores_gemma":[0.9921773,0.0009850819,0.003227254,0.00003338017,0.000007815405,0.00005364464,0.0001582606,0.00001835334,0.003338818],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002021712,"threshold_uncertainty_score":0.006763279,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2951924619","doi":"10.1021/jo034684f","title":"Diversity-Oriented Synthesis of Functionalized Pyrrolo[3,2-<i>d</i>]pyrimidines with Variation of the Pyrimidine Ring Nitrogen Substituents","year":2003,"lang":"en","type":"article","venue":"The Journal of Organic Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":21,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Université de Montréal","funders":"","keywords":"Chemistry; Pyrimidine; Isocyanate; Toluene; Pyrrole; Acetonitrile; Ring (chemistry); Yield (engineering); Medicinal chemistry; Phenyl isocyanate; Carboxylic acid; Isopropylamine; Nitrogen; Organic chemistry; Stereochemistry; Polyurethane","authors":[{"name":"Felix‐Antoine Marcotte","is_ca":true},{"name":"Frederik Rombouts","is_ca":true},{"name":"William D. Lubell","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.00956491582191934,"gpt":0.1860176050139418,"spread":0.1764526891920225,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001340637,0.0003190296,0.0003383507,0.0001616513,0.0001353476,0.0002139029,0.0002872931,0.0002465173,0.001091971],"category_scores_gemma":[0.0001883167,0.0002001508,0.0001810632,0.0001746264,0.0001132007,0.000191149,0.0001767541,0.0003299945,0.0004535228],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002350332,"about_ca_system_score_gemma":0.0002428216,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002608543,"about_ca_topic_score_gemma":0.0009169988,"domain_scores_codex":[0.999895,0.0000148561,0.00001028036,0.00002669596,0.0000228111,0.00003042134],"domain_scores_gemma":[0.9998772,0.00001545455,0.00003696657,0.00001619663,0.00001969962,0.00003445525],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00007152464,0.00001788855,0.0000796378,0.0000482483,0.000006102644,0.00009303492,0.00002222416,0.0004200825,0.9951661,0.0002164222,0.00003345076,0.003825308],"study_design_scores_gemma":[0.0000339011,0.0003955441,0.0006031972,0.000004499631,0.00001271813,0.0001951523,0.000008651631,0.0004918264,0.9942439,0.00005466221,0.003946739,0.0000091514],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9779844,0.001843583,0.01295514,0.0000576602,0.00006415233,0.0001357219,0.0005490896,0.0001461649,0.006264157],"genre_scores_gemma":[0.9706388,0.001656487,0.0229807,0.00006383099,0.00002245528,0.00009810112,0.0005641401,0.00005494951,0.003920613],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001091971,"threshold_uncertainty_score":0.00365299,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2101912079","doi":"10.2174/1874104501206010001","title":"Tricyclic Pyrazoles. Part 5. Novel 1,4-Dihydroindeno[1,2-c]pyrazole CB2 Ligands Using Molecular Hybridization Based on Scaffold Hopping","year":2012,"lang":"en","type":"article","venue":"The Open Medicinal Chemistry Journal","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":20,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":true},"ca_institutions":"","funders":"Regione Autonoma della Sardegna; Canadian Institutes of Health Research; Ministero dell’Istruzione, dell’Università e della Ricerca","keywords":"Pyrazole; Chemistry; Tricyclic; Selectivity; Stereochemistry; Carboxamide; Cannabinoid; Cannabinoid receptor type 2; Combinatorial chemistry; Cannabinoid receptor; Receptor; Biochemistry; Antagonist; Catalysis","authors":[{"name":"Gabriele Murineddu","is_ca":false},{"name":"Battistina Asproni","is_ca":false},{"name":"Stefania Ruiu","is_ca":false},{"name":"Francesco Deligia","is_ca":false},{"name":"Matteo Falzoi","is_ca":false},{"name":"Amedeo Pau","is_ca":false},{"name":"Brian F. Thomas","is_ca":false},{"name":"Yanan Zhang","is_ca":false},{"name":"Gérard A. Pinna","is_ca":false},{"name":"Luca Pani","is_ca":false},{"name":"Paolo Lazzari","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.0458307204906505,"gpt":0.2921194505263295,"spread":0.246288730035679,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001321726,0.0004545481,0.0003260766,0.0002753991,0.0001923674,0.0003186037,0.0005191077,0.0003299246,0.003220873],"category_scores_gemma":[0.0001240168,0.0001586672,0.0002674316,0.0002220155,0.0003256997,0.0002764187,0.0002717761,0.0003564746,0.0007557833],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005400492,"about_ca_system_score_gemma":0.0002595623,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.002100765,"about_ca_topic_score_gemma":0.004478711,"domain_scores_codex":[0.9999105,0.0000132579,0.000004150406,0.00002335406,0.00002077763,0.00002797027],"domain_scores_gemma":[0.9999747,0.000004786712,0.000007523191,0.000003294767,0.000003747061,0.000005970024],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0009941359,0.0007144445,0.0007906148,0.0008200284,0.00005281578,0.0003816939,0.00014616,0.005538489,0.8475777,0.003150334,0.004062023,0.1357715],"study_design_scores_gemma":[0.001071997,0.01465421,0.009833073,0.0001500432,0.0002073727,0.002865764,0.0001897582,0.02848351,0.866434,0.0008192587,0.07517847,0.0001124613],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9166408,0.022253,0.02220983,0.0007815322,0.0003422748,0.0009190144,0.001256872,0.001164221,0.0344325],"genre_scores_gemma":[0.9721555,0.007831179,0.007085867,0.0003010817,0.00003808802,0.0002742661,0.0007126032,0.0000264435,0.01157493],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003220873,"threshold_uncertainty_score":0.01077491,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2066650209","doi":"10.1139/v08-155","title":"Effect of substituents on absorption and fluorescence properties of pyrazolo[3,4-<i>b</i>]pyrrolo[2,3<b>-</b><i>d</i>]pyridines","year":2008,"lang":"en","type":"article","venue":"Canadian Journal of Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":14,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":false,"ca_venue":true,"about_ca":false},"ca_institutions":"","funders":"","keywords":"Chemistry; Substituent; Fluorescence; Pyridine; Absorption (acoustics); Yield (engineering); Stereochemistry; Photochemistry; Medicinal chemistry","authors":[{"name":"Bhausaheb K. Ghotekar","is_ca":false},{"name":"Muddassar A. Kazi","is_ca":false},{"name":"Madhukar N. Jachak","is_ca":false},{"name":"Raghunath B. Toche","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01250074558564532,"gpt":0.1934033245384357,"spread":0.1809025789527904,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001116114,0.0001987671,0.0001323051,0.00009091225,0.00008366676,0.0001080111,0.0001654499,0.0001281577,0.001449773],"category_scores_gemma":[0.0002347387,0.00009763446,0.0000763085,0.00009540454,0.00009670104,0.0001573486,0.00006505478,0.0001478754,0.00016045],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001330227,"about_ca_system_score_gemma":0.00011905,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000579239,"about_ca_topic_score_gemma":0.0009066426,"domain_scores_codex":[0.9999377,0.00001379164,0.000004008211,0.00001285211,0.00001415716,0.00001744536],"domain_scores_gemma":[0.9998972,0.00004551759,0.00002505354,0.000006292715,0.00001114024,0.00001478838],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0002613811,0.00001830913,0.000180158,0.00004565692,0.000004426569,0.00008697741,0.00002321295,0.000222055,0.9968359,0.00009718793,0.00001994309,0.002204692],"study_design_scores_gemma":[0.00001871581,0.0004720325,0.002013945,0.000005675978,0.00001523132,0.0001177079,0.00001261769,0.0005848992,0.9959246,0.00002206479,0.0008073514,0.00000510216],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9975266,0.0007174495,0.0004853543,0.00001866854,0.00000625183,0.000007417862,0.0000465804,0.00001481907,0.001176844],"genre_scores_gemma":[0.9984144,0.0004911804,0.0005577498,0.00001293042,0.000002618924,0.00000639448,0.00005886135,0.000005604039,0.0004502474],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001449773,"threshold_uncertainty_score":0.00484997,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4401655604","doi":"10.1002/adsc.202400862","title":"Shaking Up the Friedländer Reaction: Rapid, Scalable Mechanochemical Synthesis of Polyaryl‐Substituted Quinolines","year":2024,"lang":"en","type":"article","venue":"Advanced Synthesis & Catalysis","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":12,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Concordia University; McGill University; Centre in Green Chemistry and Catalysis","funders":"Fonds Québécois de la Recherche sur la Nature et les Technologies; McGill University","keywords":"Chemistry; Chemical engineering","authors":[{"name":"Daliah Farajat","is_ca":true},{"name":"Jean‐Louis Do","is_ca":true},{"name":"Pat Forgione","is_ca":true},{"name":"Tomislav Friščić","is_ca":true},{"name":"Louis A. Cuccia","is_ca":true},{"name":"Chao‐Jun Li","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01431276972359891,"gpt":0.2498187188875663,"spread":0.2355059491639674,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002023246,0.0003745101,0.0001733668,0.0002249528,0.0001265747,0.0001236361,0.0003018985,0.0002849382,0.001116594],"category_scores_gemma":[0.0001326123,0.0001390892,0.000217895,0.0001402084,0.0001923283,0.0003362459,0.0003111701,0.0004092705,0.0005685727],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001977037,"about_ca_system_score_gemma":0.0002555063,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004599116,"about_ca_topic_score_gemma":0.001178294,"domain_scores_codex":[0.9998484,0.0000134745,0.00001196465,0.0000445861,0.00004528045,0.00003628449],"domain_scores_gemma":[0.9999537,0.000009088124,0.00001514112,0.000008134275,0.000007076637,0.000006882946],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00001618241,0.00003293023,0.0000610078,0.00007457365,0.000005647971,0.00006283314,0.00002932369,0.0002987091,0.9917847,0.0006241315,0.0001503978,0.006859557],"study_design_scores_gemma":[0.00001986991,0.0003354058,0.0005710073,0.000006822534,0.000007394647,0.0001655351,0.00001533635,0.002516833,0.991523,0.0001613011,0.004660009,0.000017464],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8513272,0.004052101,0.1287777,0.0003503273,0.0001473008,0.0003587729,0.0004510609,0.001100699,0.01343482],"genre_scores_gemma":[0.963063,0.001289917,0.03238919,0.00006309972,0.00002083618,0.0001065593,0.0001645553,0.00003514122,0.002867807],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001116594,"threshold_uncertainty_score":0.003735423,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2003115052","doi":"10.1139/cjc-2012-0534","title":"A direct method for the synthesis of indolizine derivatives from easily available aromatic ketones, pyridines, and acrylonitrile derivatives","year":2013,"lang":"en","type":"article","venue":"Canadian Journal of Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":11,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":false,"ca_venue":true,"about_ca":false},"ca_institutions":"","funders":"Central China Normal University; National Natural Science Foundation of China","keywords":"Indolizine; Chemistry; Pyridinium; Acrylonitrile; Cycloaddition; Tandem; Combinatorial chemistry; 1,3-Dipolar cycloaddition; Halogenation; Organic chemistry; Azomethine ylide; Catalysis","authors":[{"name":"Qun Cai","is_ca":false},{"name":"Yanping Zhu","is_ca":false},{"name":"Yang Gao","is_ca":false},{"name":"Jingjing Sun","is_ca":false},{"name":"An‐Xin Wu","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01806764010726053,"gpt":0.2300829308929611,"spread":0.2120152907857005,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002020381,0.0006181278,0.0004038113,0.0005117496,0.0003671932,0.0002421252,0.000566069,0.0003317787,0.002380935],"category_scores_gemma":[0.0001410881,0.0003409571,0.0002752051,0.0002676708,0.0002761421,0.0004857458,0.0005080979,0.001016661,0.001173239],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003490143,"about_ca_system_score_gemma":0.0008569733,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0009348094,"about_ca_topic_score_gemma":0.002581195,"domain_scores_codex":[0.9998212,0.00001516812,0.00001781827,0.00003628482,0.00006948051,0.0000401102],"domain_scores_gemma":[0.9999456,0.000005652744,0.00001267506,0.00001109736,0.00001134886,0.00001359413],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00006334161,0.0001147002,0.0001842094,0.0007407013,0.00003666932,0.0007013231,0.0001613541,0.0008615268,0.9443781,0.006347608,0.001203974,0.0452064],"study_design_scores_gemma":[0.0000696867,0.0009522606,0.001099275,0.00004717123,0.00006553887,0.003109519,0.00004047961,0.001247123,0.9389848,0.0006863258,0.05361995,0.00007776287],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"methods","genre_gemma":"empirical","genre_scores_codex":[0.4372362,0.03452785,0.4641833,0.001117233,0.0008288929,0.001840953,0.001780878,0.001804885,0.05667963],"genre_scores_gemma":[0.7935412,0.02508347,0.1564235,0.0002145546,0.0001015978,0.0007201519,0.001180001,0.0001279889,0.02260756],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.002380935,"threshold_uncertainty_score":0.007965028,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2034456832","doi":"10.1016/j.tetlet.2009.01.064","title":"Synthesis of 3-aryl substituted benzo[1,2,5]triazepin-4-ones via intramolecular imine formation","year":2009,"lang":"en","type":"article","venue":"Tetrahedron Letters","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":10,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"AstraZeneca (Canada)","funders":"","keywords":"Chemistry; Imine; Intramolecular force; Aryl; Stereochemistry; Medicinal chemistry; Organic chemistry; Alkyl; Catalysis","authors":[{"name":"Mirosław J. Tomaszewski","is_ca":true},{"name":"Luc Boisvert","is_ca":true},{"name":"Shujuan Jin","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.0082233047377667,"gpt":0.2106152797813887,"spread":0.202391975043622,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001608761,0.0004404098,0.0003219275,0.0003178641,0.0002705049,0.0002688066,0.0006054363,0.0002812347,0.003897195],"category_scores_gemma":[0.0001316268,0.0002346149,0.000227768,0.0001872665,0.0001876515,0.0002743061,0.0003116496,0.0004108573,0.001283551],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003528602,"about_ca_system_score_gemma":0.0003774569,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003870586,"about_ca_topic_score_gemma":0.001295055,"domain_scores_codex":[0.9999031,0.00001421583,0.000007519409,0.00001512233,0.00001470618,0.00004539024],"domain_scores_gemma":[0.9999474,0.000007077739,0.00001547537,0.000006344771,0.000007208888,0.00001653519],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0006007661,0.0002274905,0.0003596942,0.0007391695,0.00004476618,0.001892211,0.0005091252,0.002843304,0.9422311,0.0110753,0.001944391,0.03753259],"study_design_scores_gemma":[0.0001458777,0.001408503,0.001831881,0.0000486934,0.00004938065,0.0007273617,0.00005654716,0.002743813,0.9543568,0.000799344,0.03776992,0.00006182084],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9148891,0.006374067,0.02108067,0.0003429128,0.0002887791,0.000297209,0.0009593464,0.0005882097,0.05517968],"genre_scores_gemma":[0.9702752,0.00306532,0.01047517,0.0001181151,0.00004731828,0.0001581501,0.0004119013,0.00006025137,0.01538863],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003897195,"threshold_uncertainty_score":0.01303738,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2952453034","doi":"10.1139/v00-096","title":"An expeditious synthesis of (±)-decahydro-5<i>H</i>-dipyrrolo [1,2-<i>a</i>:1',2'-<i>c</i>]pyrimidine-5-carbonitrile: a formal synthesis of (±)-tetraponerines-1, -2, -5, and -6","year":2000,"lang":"en","type":"article","venue":"Canadian Journal of Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":10,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":false,"ca_venue":true,"about_ca":false},"ca_institutions":"","funders":"","keywords":"Chemistry; Pyrimidine; Lactam; Stereoselectivity; Decarboxylation; Alkylation; Yield (engineering); Stereochemistry; One-pot synthesis; Combinatorial chemistry; Organic chemistry; Catalysis","authors":[{"name":"Mark Plehiers","is_ca":false},{"name":"Sylvie Heilporn","is_ca":false},{"name":"D. Ekelmans","is_ca":false},{"name":"Sabine Leclercq","is_ca":false},{"name":"Marco Sangermano","is_ca":false},{"name":"J. C. Braekman","is_ca":false},{"name":"D. Daloze","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.006221475647537886,"gpt":0.1957305089756984,"spread":0.1895090333281605,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001640025,0.0004361959,0.0002484359,0.0001715233,0.000179751,0.0001859476,0.000499676,0.0004239733,0.001985395],"category_scores_gemma":[0.0001634016,0.0001543301,0.0002259187,0.0001757823,0.0001718509,0.0003111446,0.0003509382,0.0005636141,0.001249107],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002227778,"about_ca_system_score_gemma":0.0005311162,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003968083,"about_ca_topic_score_gemma":0.001022555,"domain_scores_codex":[0.9998813,0.00001273313,0.00001591196,0.00003247228,0.00002758493,0.0000301751],"domain_scores_gemma":[0.9999179,0.000008107761,0.0000221875,0.00001563602,0.0000133202,0.00002284888],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00005360289,0.00007035982,0.0001066732,0.0003491919,0.00001677426,0.0003090959,0.00008761074,0.0005182441,0.9824542,0.001037055,0.000221849,0.01477533],"study_design_scores_gemma":[0.0000392672,0.001131332,0.001054589,0.00002257867,0.00002747448,0.0009421504,0.00002732804,0.0007970867,0.9786288,0.0002383422,0.01706047,0.00003053913],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8636789,0.008093935,0.09290643,0.0003649882,0.0003334045,0.0005441681,0.002129143,0.000771129,0.03117794],"genre_scores_gemma":[0.9386907,0.004735199,0.04738526,0.0001415754,0.00005438032,0.0001480931,0.0009861933,0.00008621453,0.00777235],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001985395,"threshold_uncertainty_score":0.006641805,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3022383985","doi":"10.1016/j.jorganchem.2020.121331","title":"Binding a meridional ligand in a facial geometry: A square peg in a round hole","year":2020,"lang":"en","type":"article","venue":"Journal of Organometallic Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":9,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Manitoba","funders":"National Institute of General Medical Sciences; National Institutes of Health; Foundation for the National Institutes of Health","keywords":"Chemistry; Ligand (biochemistry); Moiety; Isoindoline; Zonal and meridional; Crystallography; Stereochemistry; Medicinal chemistry; Physics","authors":[{"name":"Briana R. Schrage","is_ca":false},{"name":"Dominick Vitale","is_ca":false},{"name":"Kimberly A. Kelly","is_ca":false},{"name":"Victor N. Nemykin","is_ca":true},{"name":"Richard S. Herrick","is_ca":false},{"name":"Christopher J. Ziegler","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.02135455859230635,"gpt":0.2331795808467208,"spread":0.2118250222544145,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001485885,0.0002223663,0.0002251266,0.000074243,0.0002980494,0.0004197433,0.0008011681,0.0005147294,0.002127589],"category_scores_gemma":[0.0001527379,0.0001849721,0.0001531912,0.0001173321,0.0003103261,0.0006982643,0.000564211,0.0004461401,0.0006112864],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003941224,"about_ca_system_score_gemma":0.000311855,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001654686,"about_ca_topic_score_gemma":0.001744132,"domain_scores_codex":[0.999916,0.000009474432,0.00000335333,0.00002100624,0.0000155641,0.00003454272],"domain_scores_gemma":[0.9999568,0.000008751517,0.000007541078,0.000008120582,0.000003214999,0.00001553089],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.001219047,0.0002662661,0.0006412893,0.0004678636,0.00003477359,0.001510003,0.0007083585,0.01063246,0.8828344,0.05067489,0.003698359,0.04731235],"study_design_scores_gemma":[0.000308988,0.002725767,0.001491892,0.00005747066,0.00008065655,0.0009980248,0.000501472,0.04282545,0.8926906,0.006223695,0.05196431,0.0001316244],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9702799,0.0005338651,0.01426866,0.0006980626,0.0001833477,0.00007823773,0.00008930676,0.0003205105,0.01354814],"genre_scores_gemma":[0.9831685,0.0003757123,0.008798251,0.000162731,0.00001065201,0.00002639452,0.0000393308,0.00003816524,0.007380267],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002127589,"threshold_uncertainty_score":0.00711751,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4239152769","doi":"10.1002/ange.201609726","title":"Development and Cycloaddition Reactivity of a New Class of Pyridine‐Based Mesoionic 1,3‐Dipole","year":2016,"lang":"en","type":"article","venue":"Angewandte Chemie","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":7,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"McGill University","funders":"Fonds de recherche du Québec – Nature et technologies; Natural Sciences and Engineering Research Council of Canada; Centre in Green Chemistry and Catalysis","keywords":"Mesoionic; Pyridine; Cycloaddition; Reactivity (psychology); Quinoline; Chemistry; Dipole; 1,3-Dipolar cycloaddition; Alkyne; Combinatorial chemistry; Computational chemistry; Organic chemistry; Catalysis","authors":[{"name":"Huseyin Erguven","is_ca":true},{"name":"David C. Leitch","is_ca":true},{"name":"Evan N. Keyzer","is_ca":true},{"name":"Bruce A. Arndtsen","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.02519272896062155,"gpt":0.2366520646363951,"spread":0.2114593356757735,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002073235,0.000175981,0.0001000165,0.0001850937,0.0001082367,0.0002011029,0.0003149135,0.0001935574,0.001141093],"category_scores_gemma":[0.0002580583,0.00008643781,0.0001129236,0.0001015561,0.0002272389,0.0001996164,0.000217148,0.0003966049,0.0002630792],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002973024,"about_ca_system_score_gemma":0.0001651265,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003419984,"about_ca_topic_score_gemma":0.0004253255,"domain_scores_codex":[0.9999014,0.00001331711,0.000004982366,0.00001794239,0.00003862731,0.00002370398],"domain_scores_gemma":[0.9998896,0.00002080859,0.00003219233,0.0000171821,0.00001709596,0.00002315373],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00006161728,0.00003507595,0.0002573319,0.00006208913,0.000006494291,0.00009050758,0.00003821336,0.0005288704,0.9921789,0.001569893,0.0001169427,0.005054126],"study_design_scores_gemma":[0.00001268092,0.0002614306,0.0006823211,0.000003617651,0.000004874506,0.0001758132,0.000009462617,0.0008191377,0.9940255,0.0001018932,0.003895858,0.000007464096],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9777304,0.001918923,0.01106294,0.0001396059,0.00003243209,0.00008526711,0.0002344768,0.0001218152,0.008674196],"genre_scores_gemma":[0.9953049,0.0005307996,0.002833301,0.00002456898,0.000004771316,0.00001945105,0.0001082249,0.000009067863,0.001164919],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001141093,"threshold_uncertainty_score":0.003817379,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2954839824","doi":"10.1016/j.bmcl.2019.06.047","title":"Molecular and cellular studies evaluating a potent 2-cyanoindolizine catechol diether NNRTI targeting wildtype and Y181C mutant HIV-1 reverse transcriptase","year":2019,"lang":"en","type":"letter","venue":"Bioorganic & Medicinal Chemistry Letters","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":7,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"","funders":"Brookhaven National Laboratory; National Institute of Allergy and Infectious Diseases; National Institute of General Medical Sciences; McGill University; U.S. Department of Energy; Office of Science; National Cancer Institute; National Institutes of Health; National Science Foundation","keywords":"Chemistry; Mutant; Moiety; Potency; Catechol; Stereochemistry; Hydrogen bond; Reverse transcriptase; In vitro; Biochemistry; Molecule","authors":[{"name":"Tomoaki Sasaki","is_ca":false},{"name":"Zira T. K. Gannam","is_ca":false},{"name":"Shalley N. Kudalkar","is_ca":false},{"name":"Kathleen M. Frey","is_ca":false},{"name":"Won‐Gil Lee","is_ca":false},{"name":"Krasimir A. Spasov","is_ca":false},{"name":"William L. Jorgensen","is_ca":false},{"name":"Karen S. Anderson","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.0272887714606392,"gpt":0.256618024623656,"spread":0.2293292531630167,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002050614,0.0001671061,0.0002470865,0.00009585503,0.0001833606,0.0003252885,0.0002536918,0.0004594581,0.001287144],"category_scores_gemma":[0.0001739086,0.00009903423,0.0001247295,0.00009743839,0.0002027757,0.0001923676,0.00008380426,0.0004308297,0.0002930145],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004049063,"about_ca_system_score_gemma":0.0001532783,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001707675,"about_ca_topic_score_gemma":0.002705213,"domain_scores_codex":[0.9998634,0.00003701827,0.000008305818,0.00001640518,0.00003631917,0.00003843473],"domain_scores_gemma":[0.9999082,0.00003996225,0.000007752497,0.00001024036,0.00002012222,0.00001370037],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0007137493,0.0001776418,0.0003163206,0.00005494427,0.000008961609,0.0004294241,0.0000470074,0.0002467702,0.9929315,0.0004256102,0.0003287828,0.004319238],"study_design_scores_gemma":[0.0001354855,0.004070368,0.003045863,0.000003224849,0.00003315293,0.0008204153,0.0000641406,0.001473978,0.984524,0.0001116819,0.005710539,0.000007256194],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9913622,0.001631344,0.001047761,0.000508926,0.00009626119,0.00005943292,0.0002986676,0.00003067443,0.004964765],"genre_scores_gemma":[0.994187,0.001054926,0.0009457144,0.0001362904,0.00003997457,0.00002959031,0.0002927,0.0000092828,0.003304588],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001707675,"threshold_uncertainty_score":0.004305899,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4392763145","doi":"10.1002/chem.202400421","title":"Leveraging Pyrazolium Ylide Reactivity to Access Indolizine and 1,2‐Dihydropyrimidine Derivatives","year":2024,"lang":"en","type":"article","venue":"Chemistry - A European Journal","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":7,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Calgary","funders":"Natural Sciences and Engineering Research Council of Canada; Government of Alberta","keywords":"Indolizine; Reactivity (psychology); Ylide; Chemistry; Medicinal chemistry; Medicine","authors":[{"name":"Ricky Tran","is_ca":true},{"name":"Duncan K. Brownsey","is_ca":true},{"name":"Leonie O’Sullivan","is_ca":true},{"name":"Connor M. J. Brandow","is_ca":true},{"name":"E. Chang","is_ca":true},{"name":"Wen Zhou","is_ca":true},{"name":"Ketul V. Patel","is_ca":true},{"name":"Evgueni Gorobets","is_ca":true},{"name":"Darren J. Derksen","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.03498124366320619,"gpt":0.2775168922632288,"spread":0.2425356486000226,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002387208,0.0003790447,0.0001740184,0.0002799685,0.0001619363,0.0003318312,0.000324542,0.0003114001,0.001828257],"category_scores_gemma":[0.0002772438,0.000133175,0.0001432421,0.0002061719,0.0002013348,0.0004358625,0.0004579718,0.0004838811,0.0007231099],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003092165,"about_ca_system_score_gemma":0.0002814898,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003634064,"about_ca_topic_score_gemma":0.001229736,"domain_scores_codex":[0.9998693,0.00001591066,0.00001095167,0.00002389132,0.00003286256,0.00004693171],"domain_scores_gemma":[0.9999138,0.00001827988,0.00002714305,0.00001359626,0.00001161749,0.00001558085],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0000926803,0.00009112056,0.0002654299,0.0001670065,0.00001122408,0.0003443286,0.0001253676,0.001337515,0.9848172,0.003187041,0.0003605982,0.009200521],"study_design_scores_gemma":[0.00003060688,0.0004482387,0.0007264704,0.00001369598,0.00001213317,0.0002507602,0.00002415868,0.0020665,0.9884744,0.0002717536,0.007663167,0.00001806701],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9625,0.002068979,0.01165239,0.00023291,0.00006704711,0.0001464779,0.0004141644,0.0002906522,0.02262739],"genre_scores_gemma":[0.9924273,0.001452168,0.003486007,0.00005045094,0.00001433056,0.00004138875,0.0001823679,0.00003493442,0.00231106],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001828257,"threshold_uncertainty_score":0.006116092,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2763187625","doi":"10.1021/acs.organomet.7b00696","title":"Binding Modes and Reactivity of Pyrido[2,1-<i>a</i>]isoindole as a Neutral Carbon Donor with Main-Group and Transition-Metal Elements","year":2017,"lang":"en","type":"article","venue":"Organometallics","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":7,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Queen's University","funders":"Natural Sciences and Engineering Research Council of Canada; Government of Canada","keywords":"Isoindole; Chemistry; Adduct; Nucleophile; Transition metal; Stereochemistry; Molecule; Reactivity (psychology); Dimer; Carbon atom; Medicinal chemistry; Crystallography; Ring (chemistry); Organic chemistry; Catalysis","authors":[{"name":"Sean M. McDonald","is_ca":true},{"name":"Soren K. Mellerup","is_ca":true},{"name":"Christopher Barran","is_ca":true},{"name":"Xiang Wang","is_ca":true},{"name":"Suning Wang","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01151936319220468,"gpt":0.222869042200424,"spread":0.2113496790082193,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001589057,0.0002567476,0.0001376478,0.0002216454,0.0001375766,0.0001700711,0.0004843693,0.0003395391,0.002394279],"category_scores_gemma":[0.0001284285,0.000187467,0.000124056,0.0001079196,0.0001436466,0.0001790164,0.0001093018,0.000261895,0.0004169219],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001947409,"about_ca_system_score_gemma":0.00009063855,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0009548563,"about_ca_topic_score_gemma":0.001321,"domain_scores_codex":[0.9998722,0.00002329947,0.000003771337,0.00003314258,0.00003236641,0.00003510564],"domain_scores_gemma":[0.9999053,0.00002965749,0.00002165247,0.000008546375,0.00001518725,0.00001957666],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00008665866,0.00001091187,0.0001057128,0.00002529202,0.000003441382,0.00005148443,0.00001947036,0.00006021287,0.9985955,0.00007992527,0.00007166294,0.0008896238],"study_design_scores_gemma":[0.00000455279,0.0001124085,0.001997566,0.00000269165,0.0000045925,0.0001372892,0.00002338297,0.0007846078,0.9961653,0.0000180507,0.000743674,0.000005830004],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9888154,0.001005757,0.004415854,0.00006484945,0.00001190481,0.00001673515,0.0002273185,0.0001618038,0.00528044],"genre_scores_gemma":[0.9886069,0.0004961022,0.004984889,0.00005276487,0.000007029367,0.00002738123,0.0003695884,0.00003759198,0.005417676],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002394279,"threshold_uncertainty_score":0.008009672,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2886162375","doi":"10.1139/cjc-2017-0564","title":"Synthesis of novel <i>N</i>-functionalized 4-aryl-tetrahydrobiquinoline-2,5-(1<i>H</i>,3<i>H</i>)-diones via one-pot three-component reaction: a joint experimental and computational study","year":2018,"lang":"en","type":"article","venue":"Canadian Journal of Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":6,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":false,"ca_venue":true,"about_ca":false},"ca_institutions":"","funders":"","keywords":"Dimedone; Chemistry; Aryl; Component (thermodynamics); Computational chemistry; Density functional theory; Series (stratigraphy); Reaction mechanism; Stereochemistry; Organic chemistry; Catalysis; Thermodynamics","authors":[{"name":"Vahideh Zadsirjan","is_ca":false},{"name":"Sayyed Jalil Mahdizadeh","is_ca":false},{"name":"Majid M. Heravı","is_ca":false},{"name":"Masumeh Heydari","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.02652140027283049,"gpt":0.2328044168040423,"spread":0.2062830165312118,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00009172157,0.000300476,0.0002021543,0.00009037799,0.0001278382,0.000179355,0.0003431698,0.0001602913,0.001462507],"category_scores_gemma":[0.0001099444,0.00008719165,0.0001607014,0.00008789413,0.0001124444,0.0002240198,0.0001463644,0.000155985,0.0002728075],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00027487,"about_ca_system_score_gemma":0.000216406,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001083134,"about_ca_topic_score_gemma":0.002803139,"domain_scores_codex":[0.9999712,0.000002655866,0.00000141324,0.000006749099,0.000009732327,0.000008183437],"domain_scores_gemma":[0.9999686,0.000007250119,0.000009583255,0.000003128108,0.000006078761,0.000005407619],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0004880047,0.0002288759,0.001941713,0.00139852,0.00005918204,0.001025468,0.0001052287,0.05965539,0.8956298,0.006985286,0.001168207,0.03131426],"study_design_scores_gemma":[0.0002553832,0.00184616,0.003237122,0.00004051715,0.0001007601,0.0005052745,0.0001282346,0.1229086,0.8496655,0.001253131,0.01999867,0.00006065906],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9758548,0.00177298,0.01132957,0.00006468744,0.00003402238,0.00008684795,0.0005367828,0.0001514388,0.01016901],"genre_scores_gemma":[0.9872432,0.0009322036,0.009663843,0.00002263032,0.000002132654,0.00004374168,0.0002454522,0.00001319289,0.001833697],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001462507,"threshold_uncertainty_score":0.004892588,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2022106576","doi":"10.1007/s10870-005-3249-6","title":"Methyl 4-((E)-2-{3-[(3-{ (E)-2-[4-(methoxycarbonyl)phenyl]- 1-diazenyl}-5,5-dimethylhexahydro-1-pyrimidinyl)methyl]-5,5-dimethylhexahydro-1-pyrimidinyl-1-diazenyl) benzoate. X-ray crystal structure","year":2005,"lang":"en","type":"article","venue":"Journal of Chemical Crystallography","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":6,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Saint Mary's University","funders":"","keywords":"Triclinic crystal system; Chemistry; Triazene; Crystal structure; Molecule; Crystallography; Stereochemistry; van der Waals force; Organometallic chemistry; Organic chemistry","authors":[{"name":"Shasta Lee Moser","is_ca":true},{"name":"V. Bertolasi","is_ca":false},{"name":"Keith Vaughan","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.009958401668181722,"gpt":0.2312733295451622,"spread":0.2213149278769805,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001402724,0.0001786801,0.0003446903,0.0001676072,0.0002387957,0.0001870256,0.0008095854,0.0002606219,0.01029203],"category_scores_gemma":[0.0001477177,0.0001595286,0.00006599926,0.000227568,0.000138349,0.0002588822,0.0001862316,0.0003305035,0.002877331],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000387713,"about_ca_system_score_gemma":0.0007000213,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.003851196,"about_ca_topic_score_gemma":0.004971167,"domain_scores_codex":[0.9999051,0.00001112407,0.000002676423,0.0000209319,0.00002346447,0.00003676663],"domain_scores_gemma":[0.9999554,0.00000571092,0.000008722101,0.000005395658,0.000006634829,0.00001805499],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.001732708,0.000228202,0.0005089066,0.0006164736,0.00004589766,0.0003390177,0.000080693,0.001354293,0.9552531,0.004816506,0.0117221,0.02330199],"study_design_scores_gemma":[0.0008552321,0.001042972,0.003913976,0.00005487343,0.00004585249,0.0005168461,0.0001067297,0.001816785,0.8218083,0.0007780304,0.168988,0.00007243003],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8522542,0.00885494,0.01568238,0.001925359,0.0006137113,0.00038315,0.007831048,0.001499409,0.1109558],"genre_scores_gemma":[0.9347556,0.003914006,0.005538465,0.0003634993,0.00004764616,0.0001667511,0.003319736,0.00008312808,0.05181114],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01029203,"threshold_uncertainty_score":0.03443027,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W242847070","doi":"10.1107/s1600536806045119","title":"Chloro[2-(dimethylamino)benzyl-κ<sup>2</sup><i>C</i><sup>1</sup>,<i>N</i>][4-(dimethylamino)pyridine-κ<i>N</i><sup>1</sup>]palladium(II)","year":2006,"lang":"en","type":"article","venue":"Acta Crystallographica Section E Structure Reports Online","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":6,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Queen's University","funders":"","keywords":"Pyridine; Chemistry; Dihedral angle; Palladium; Amine gas treating; Crystallography; Crystal structure; Benzene; Stereochemistry; Medicinal chemistry; Molecule; Hydrogen bond; Catalysis; Organic chemistry","authors":[{"name":"Hoong‐Kun Fun","is_ca":false},{"name":"Suchada Chantrapromma","is_ca":false},{"name":"Zhong‐Lin Lu","is_ca":true},{"name":"Alexei A. Neverov","is_ca":true},{"name":"R. S. Brown","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.007414287396647541,"gpt":0.2196816215198334,"spread":0.2122673341231859,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00009816631,0.0003052945,0.0002874065,0.0001571681,0.0001737639,0.0002647642,0.0006075485,0.0002185805,0.006898397],"category_scores_gemma":[0.000140246,0.0002520817,0.0001075627,0.0003357365,0.0002392991,0.0002078409,0.0002049293,0.0004872687,0.002422411],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003900931,"about_ca_system_score_gemma":0.000422639,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001556426,"about_ca_topic_score_gemma":0.002375614,"domain_scores_codex":[0.9998614,0.00001384332,0.00000513533,0.00004067725,0.00004348485,0.00003545389],"domain_scores_gemma":[0.9999399,0.000008369685,0.00001763341,0.00001266631,0.000008036936,0.00001338314],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0007016615,0.00007449897,0.000421837,0.0007979724,0.00003301266,0.0002881581,0.00007237813,0.0006858322,0.9701462,0.002243081,0.00469641,0.01983904],"study_design_scores_gemma":[0.000287774,0.0004580247,0.002655602,0.000050249,0.00003365288,0.0008156549,0.0000874871,0.001004,0.8578449,0.0004269163,0.1362985,0.00003722718],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8277338,0.009843511,0.02147404,0.0008763791,0.0007506642,0.000281382,0.003999438,0.003051021,0.1319898],"genre_scores_gemma":[0.9534115,0.004011821,0.00745268,0.0003526003,0.00007128174,0.000124889,0.00342403,0.0001530812,0.03099814],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.006898397,"threshold_uncertainty_score":0.02307743,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2099853746","doi":"10.1002/0471264229.os084.26","title":"Preparation of Substituted 5‐Aziandoles: Methyl 4‐Chloro‐1 <i> <scp>H</scp> </i> ‐Pyrrolo[3,2‐ <i> <scp>C</scp> </i> ]Pyridine‐2‐Carboxylate","year":2007,"lang":"en","type":"other","venue":"Organic Syntheses","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":5,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Merck Canada Inc. (Canada)","funders":"","keywords":"Chemistry; Mesitylene; Methyl acrylate; Sodium azide; Carboxylate; Pyridine; Medicinal chemistry; Acrylate; Sodium; Stereochemistry; Organic chemistry; Catalysis; Polymer","authors":[{"name":"Patrick Roy","is_ca":true},{"name":"Michel Boisvert","is_ca":false},{"name":"Yves Leblanc","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01653356707186234,"gpt":0.2583287536371938,"spread":0.2417951865653314,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001494932,0.0004326581,0.0002748535,0.0002108561,0.0001983209,0.0001833556,0.0004484402,0.0002419789,0.002987196],"category_scores_gemma":[0.00009985726,0.0001947721,0.0001337372,0.0001680844,0.0001239502,0.0001988567,0.0002413384,0.0003026529,0.001059192],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003925704,"about_ca_system_score_gemma":0.0002744557,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0008849988,"about_ca_topic_score_gemma":0.002298866,"domain_scores_codex":[0.9999062,0.00001176111,0.000007335361,0.00002207573,0.00002521573,0.00002727508],"domain_scores_gemma":[0.999953,0.000005239683,0.00001147525,0.000007474655,0.000008187098,0.00001463443],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00006723551,0.00001581787,0.00005020823,0.00007111976,0.000008028383,0.00006359068,0.00002242211,0.0002144821,0.995494,0.000497981,0.0001416144,0.003353466],"study_design_scores_gemma":[0.00001487773,0.0001178575,0.0004694513,0.000003744406,0.000005635876,0.0000681513,0.000005572607,0.0002274723,0.9952784,0.00002918237,0.003774931,0.000004847849],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"methods","genre_scores_codex":[0.9477504,0.003441031,0.01892315,0.0001830963,0.0001040901,0.0002510293,0.001318501,0.0003260753,0.02770271],"genre_scores_gemma":[0.9674232,0.001927614,0.01030589,0.00008142875,0.00001619941,0.0001401715,0.001047873,0.0000680623,0.01898969],"genre_candidate":"methods","genre_consensus":null,"teacher_disagreement_score":0.002987196,"threshold_uncertainty_score":0.009993196,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4406450345","doi":"10.1002/chem.202404420","title":"Phosphorus‐Nitrogen Heterocycles Derived from Chelating <i>N</i> ‐Donor Ligands: Historical Advances, Recent Highlights, and Outlook","year":2025,"lang":"en","type":"article","venue":"Chemistry - A European Journal","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":4,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Western University","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Phosphorus; Chelation; Nitrogen; Chemistry; Environmental chemistry; Organic chemistry","authors":[{"name":"Shrabani Khan","is_ca":true},{"name":"Joe B. Gilroy","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01044383788385083,"gpt":0.2090516099265312,"spread":0.1986077720426803,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0006142972,0.0003013176,0.0002562203,0.0004513588,0.0002599593,0.0006293749,0.0003407331,0.0004817769,0.002213872],"category_scores_gemma":[0.0003842069,0.0002115432,0.0001582581,0.0006078914,0.0005518926,0.001207891,0.0005206689,0.0009660959,0.0007047179],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000534241,"about_ca_system_score_gemma":0.0003931487,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004941181,"about_ca_topic_score_gemma":0.001084221,"domain_scores_codex":[0.9998869,0.00002394246,0.000009183026,0.00003047801,0.00002766227,0.00002183134],"domain_scores_gemma":[0.9998747,0.00006381462,0.00002060738,0.000006896607,0.00001990534,0.00001406882],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"design_other","study_design_gemma":"theoretical_or_conceptual","study_design_scores_codex":[0.0002648768,0.0001919641,0.0006944685,0.01294542,0.0000607592,0.0009366156,0.0007007144,0.003013133,0.09113047,0.1089837,0.02022909,0.7608488],"study_design_scores_gemma":[0.00001542958,0.0004515436,0.0005256145,0.000679801,0.00002521129,0.001170481,0.0001507047,0.0007151677,0.04786659,0.005691104,0.9426689,0.00003955474],"study_design_candidate":"theoretical_or_conceptual","study_design_consensus":null,"genre_codex":"review","genre_gemma":"review","genre_scores_codex":[0.01522179,0.9544764,0.004300585,0.001646959,0.0005603795,0.00002418003,0.0000808183,0.00004605753,0.02364282],"genre_scores_gemma":[0.07836845,0.9058905,0.004406187,0.001215441,0.0006629769,0.00004425309,0.0001206453,0.00003439267,0.00925706],"genre_candidate":"review","genre_consensus":"review","teacher_disagreement_score":0.002213872,"threshold_uncertainty_score":0.007406116,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W1964444405","doi":"10.1139/cjc-2014-0494","title":"A facile approach for the synthesis of 1,3-di- and 1,2,3-tri-substituted indolizines","year":2015,"lang":"en","type":"article","venue":"Canadian Journal of Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":4,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":false,"ca_venue":true,"about_ca":false},"ca_institutions":"","funders":"","keywords":"Chemistry; Pyridinium; Salt (chemistry); 1,2-Dichloroethane; Dichloroethane; Combinatorial chemistry; Organic chemistry; Medicinal chemistry; Catalysis","authors":[{"name":"Jun Tan","is_ca":false},{"name":"Yiwen Yang","is_ca":false},{"name":"Jie Chen","is_ca":false},{"name":"Chunxiang Kuang","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.03448608316369419,"gpt":0.2210554813199476,"spread":0.1865693981562534,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002202892,0.0003613713,0.0003416308,0.0003449528,0.0002874175,0.0002198951,0.0005497875,0.0003325745,0.001651854],"category_scores_gemma":[0.000127104,0.0002089857,0.0002076957,0.0002277302,0.0002524641,0.0003083084,0.000383803,0.0008473647,0.0005221188],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004016847,"about_ca_system_score_gemma":0.0006239251,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00068126,"about_ca_topic_score_gemma":0.002560828,"domain_scores_codex":[0.9998661,0.00001491598,0.00001075015,0.00002286188,0.00004419859,0.00004110009],"domain_scores_gemma":[0.9999493,0.000006199403,0.000009902612,0.000009529209,0.000009735931,0.00001526401],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00004788712,0.00003771356,0.00006516345,0.0001481832,0.000008988272,0.0001752651,0.00008232452,0.0004720453,0.988277,0.003053822,0.000195741,0.007435997],"study_design_scores_gemma":[0.00004459063,0.0004502092,0.0006446185,0.0000148199,0.0000172626,0.0007523995,0.00002762334,0.001261122,0.9820411,0.0005242736,0.01418759,0.00003434857],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8751792,0.007735087,0.08836885,0.0006396413,0.0001644765,0.0004726855,0.0008694925,0.0006390907,0.02593139],"genre_scores_gemma":[0.9463499,0.004859232,0.04168034,0.000133008,0.0000217238,0.0001825553,0.0004362955,0.00006395144,0.006273052],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001651854,"threshold_uncertainty_score":0.005526006,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4315621837","doi":"10.1007/s10593-023-03142-w","title":"Di-, tetra-, and perhydropyrrolo[1,2-a]imidazoles: The Methods of Synthesis and Some Aspects of Application","year":2022,"lang":"en","type":"article","venue":"Chemistry of Heterocyclic Compounds","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":4,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Université de Sherbrooke","funders":"","keywords":"Tetra; Chemistry; Ring (chemistry); Combinatorial chemistry; Organic chemistry; Medicinal chemistry","authors":[{"name":"Lesya Saliyeva","is_ca":false},{"name":"Irina V. Dyachenko","is_ca":true},{"name":"Ivanna Yu. Danyliuk","is_ca":false},{"name":"М. В. Вовк","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01226604310302747,"gpt":0.2605196330377617,"spread":0.2482535899347342,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0006926727,0.0005021057,0.0003742246,0.0006131328,0.000429242,0.0005690468,0.001068205,0.0005737079,0.002400005],"category_scores_gemma":[0.0003643599,0.000303052,0.0001667776,0.0005302315,0.0006978522,0.0009074153,0.0003950191,0.0007236208,0.001224553],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00107058,"about_ca_system_score_gemma":0.0005511375,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0008706067,"about_ca_topic_score_gemma":0.0015505,"domain_scores_codex":[0.9997699,0.00004727688,0.00001804765,0.00005740482,0.00006490931,0.00004249244],"domain_scores_gemma":[0.9998771,0.00002302203,0.0000340742,0.00001994702,0.0000227152,0.00002308799],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0005621361,0.000312584,0.0003983595,0.001289214,0.0000242807,0.0002785339,0.0002913454,0.001358932,0.8119412,0.04089206,0.002038593,0.1406126],"study_design_scores_gemma":[0.00008507769,0.001005556,0.001359497,0.00006338157,0.00002774167,0.001273892,0.000119218,0.002264554,0.8336192,0.003477311,0.1566435,0.00006102483],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"review","genre_gemma":"methods","genre_scores_codex":[0.2631361,0.4272516,0.2316641,0.003246814,0.002007189,0.0004943548,0.0009921502,0.001249069,0.06995864],"genre_scores_gemma":[0.6583283,0.1549749,0.1350878,0.0008968299,0.0006500719,0.000559405,0.0006093457,0.0002006301,0.04869279],"genre_candidate":"methods","genre_consensus":null,"teacher_disagreement_score":0.002400005,"threshold_uncertainty_score":0.008028865,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2953379557","doi":"10.1016/b0-08-043748-6/01075-6","title":"Heterocyclic and Open-chain 1,2-Diazine Ligands","year":2003,"lang":"en","type":"book-chapter","venue":"Elsevier eBooks","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":4,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Memorial University of Newfoundland","funders":"","keywords":"Diazine; Chain (unit); Chemistry; Stereochemistry; Physics","authors":[{"name":"Zhiqiang Xu","is_ca":true},{"name":"Laurence K. Thompson","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01920241498663171,"gpt":0.2401392205700627,"spread":0.2209368055834309,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00009030441,0.0003862195,0.0002733761,0.0002160359,0.0002201609,0.0004472813,0.0005648674,0.0003364011,0.01580441],"category_scores_gemma":[0.00007149451,0.0001473387,0.0001044683,0.0003254969,0.0002767554,0.0006280629,0.0004524185,0.0005679108,0.004492145],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005619646,"about_ca_system_score_gemma":0.0002200004,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004496842,"about_ca_topic_score_gemma":0.001124094,"domain_scores_codex":[0.9999347,0.000006041728,0.000001683419,0.00001554718,0.00003025589,0.00001178834],"domain_scores_gemma":[0.9999813,0.000006606581,0.000002556823,0.000001903352,0.000002580797,0.000005112294],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"design_other","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0003407194,0.0001905778,0.0001268979,0.001321444,0.00001514648,0.0005130239,0.0003346157,0.002835666,0.4044164,0.1238452,0.03583944,0.4302208],"study_design_scores_gemma":[0.00003130206,0.0001701876,0.0005619961,0.000145941,0.00001052475,0.0008578791,0.00007981989,0.0016135,0.1109538,0.02741359,0.8581329,0.0000285238],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"other","genre_gemma":"empirical","genre_scores_codex":[0.07255533,0.1636519,0.0312299,0.001208414,0.0009617584,0.00008029155,0.0007047073,0.0006179881,0.7289897],"genre_scores_gemma":[0.1783305,0.07881841,0.01478351,0.0007805512,0.0002935629,0.000141868,0.0008924454,0.0001814891,0.7257777],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.01580441,"threshold_uncertainty_score":0.05287099,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2951977816","doi":"10.1016/j.tetlet.2011.12.132","title":"Rapid access to pyrido[1,2,5]triazepin-4-ones through intramolecular nucleophilic aromatic substitution","year":2012,"lang":"en","type":"article","venue":"Tetrahedron Letters","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":3,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"AstraZeneca (Canada)","funders":"Princeton University","keywords":"Chemistry; Nucleophilic aromatic substitution; Intramolecular force; Hydrazone; Nucleophilic substitution; Radical-nucleophilic aromatic substitution; Substitution (logic); Stereochemistry; Substitution reaction; Medicinal chemistry","authors":[{"name":"Shujuan Jin","is_ca":true},{"name":"Olivier St‐Jean","is_ca":true},{"name":"Sandra I. Baltatu","is_ca":true},{"name":"Vijayaratnam Santhakumar","is_ca":true},{"name":"Mirosław J. Tomaszewski","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.03454155266831475,"gpt":0.2713326348063813,"spread":0.2367910821380666,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000260886,0.0005333547,0.000308491,0.0003370087,0.000429997,0.0003815866,0.0006099197,0.0003656209,0.007615521],"category_scores_gemma":[0.0001504152,0.0002764168,0.0002015434,0.0002112713,0.0003780896,0.0005085352,0.0007446301,0.0006351468,0.001840307],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004121299,"about_ca_system_score_gemma":0.0003914168,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004049311,"about_ca_topic_score_gemma":0.001153906,"domain_scores_codex":[0.9998488,0.00002120703,0.000008323125,0.00002390619,0.00002300527,0.00007464435],"domain_scores_gemma":[0.9999588,0.000007028354,0.00001007006,0.000006007715,0.000003990187,0.00001428437],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.001121729,0.0003909001,0.0006578516,0.001099892,0.00006393704,0.003373847,0.001171659,0.004675944,0.8285441,0.06303462,0.01060173,0.08526388],"study_design_scores_gemma":[0.0005414212,0.002557609,0.002901275,0.0001029675,0.00006467599,0.002683536,0.0001570376,0.006119892,0.8527144,0.004365651,0.1276466,0.000144994],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.7987809,0.008069281,0.02616517,0.0009675268,0.0005578897,0.0003364334,0.0006881447,0.0008903106,0.1635443],"genre_scores_gemma":[0.9682724,0.004987006,0.005423205,0.0001822293,0.0001451488,0.000108514,0.0003068649,0.00006446972,0.02051023],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.007615521,"threshold_uncertainty_score":0.0254764,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2951397306","doi":"10.1039/c9ob00923j","title":"Push–pull isomers of indolizino[6,5,4,3-<i>def</i>]phenanthridine decorated with a triarylboron moiety","year":2019,"lang":"en","type":"article","venue":"Organic & Biomolecular Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":3,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Queen's University","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Chemistry; Phenanthridine; Moiety; Fluorescence; Structural isomer; Cycloaddition; Photochemistry; Stereochemistry; Organic chemistry; Catalysis","authors":[{"name":"Lei Dong","is_ca":true},{"name":"Felix Saraci","is_ca":true},{"name":"Kang Yuan","is_ca":true},{"name":"Xiang Wang","is_ca":true},{"name":"Suning Wang","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.003976222928982658,"gpt":0.1867493886673087,"spread":0.182773165738326,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00008865255,0.0003126987,0.0001620928,0.0001186251,0.00009661689,0.0001834621,0.0002903067,0.0001854044,0.001353647],"category_scores_gemma":[0.00009552425,0.0001367029,0.0001304634,0.0001305993,0.0001629526,0.0001665586,0.0001585178,0.0003038012,0.0003545577],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001740846,"about_ca_system_score_gemma":0.0001107825,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000382849,"about_ca_topic_score_gemma":0.0008977849,"domain_scores_codex":[0.9999284,0.000007138974,0.000004874471,0.00002186725,0.00001523012,0.00002253393],"domain_scores_gemma":[0.999933,0.000009125942,0.00002296639,0.00001220818,0.000006552121,0.00001613237],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00008566858,0.00001417186,0.00008704654,0.00002509373,0.000005777506,0.00004803707,0.0000177686,0.00008464161,0.9975294,0.0003284213,0.00005366507,0.001720307],"study_design_scores_gemma":[0.000008163937,0.0001540949,0.0004353867,0.000001195459,0.000005082318,0.00007883876,0.000009256812,0.0002699184,0.9981878,0.00002590214,0.0008199521,0.000004347539],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9932423,0.000196969,0.002713153,0.0000347438,0.00001595881,0.00002512258,0.0001660268,0.00008443327,0.003521231],"genre_scores_gemma":[0.9943174,0.0001639535,0.002561257,0.00002155377,0.000002975384,0.00002188107,0.0001690724,0.00003283071,0.002708998],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001353647,"threshold_uncertainty_score":0.004528403,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2950029399","doi":"10.1002/chin.200402094","title":"Highly Efficient Synthesis of O‐(2,4‐Dinitrophenyl)hydroxylamine. Application to the Synthesis of Substituted N‐Benzoyliminopyridinium Ylides.","year":2003,"lang":"en","type":"article","venue":"ChemInform","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":3,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Université de Montréal","funders":"","keywords":"Chemistry; Hydroxylamine; Dinitrophenyl; Medicinal chemistry; Combinatorial chemistry; Organic chemistry","authors":[{"name":"Claude Y. Legault","is_ca":true},{"name":"André B. Charette","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01067970840634631,"gpt":0.2143107851806018,"spread":0.2036310767742555,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001701496,0.0003408842,0.0001880782,0.0001276896,0.0001566183,0.0001864663,0.0002952157,0.0002598676,0.001705951],"category_scores_gemma":[0.0001447111,0.0001656264,0.00009221092,0.0001144535,0.0001447924,0.0002244185,0.0002295573,0.0002941514,0.0007619202],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002764292,"about_ca_system_score_gemma":0.0003510202,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004241693,"about_ca_topic_score_gemma":0.001195993,"domain_scores_codex":[0.9999249,0.00001334934,0.000005751848,0.00001565153,0.00001595465,0.00002437216],"domain_scores_gemma":[0.9999355,0.00001183012,0.00001796112,0.00000821273,0.000009819138,0.00001670805],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00006250456,0.00002040401,0.00005556954,0.0001185798,0.000004899023,0.0001185375,0.00003280889,0.0001523049,0.9910387,0.0006336888,0.0002079876,0.00755399],"study_design_scores_gemma":[0.00002640424,0.0001647266,0.0003879232,0.000006510878,0.000007442325,0.0002394408,0.00001301516,0.0004092588,0.9920453,0.00008465236,0.006608212,0.000007226928],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8917929,0.008775767,0.06422789,0.0003859467,0.0002183442,0.0002315004,0.001145645,0.0004004269,0.03282161],"genre_scores_gemma":[0.9713106,0.003291852,0.01739587,0.00005497274,0.00001612816,0.00006502376,0.0004964264,0.0000462721,0.007322912],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001705951,"threshold_uncertainty_score":0.005706966,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W1982806351","doi":"10.1007/s10870-009-9533-0","title":"Solid State Structure of 6,7-Dihydro-1,4-Di(2′-Pyridyl)-5H-Cyclopenta[d]Pyridazine","year":2009,"lang":"en","type":"article","venue":"Journal of Chemical Crystallography","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":2,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Memorial University of Newfoundland","funders":"","keywords":"Pyridazine; Triclinic crystal system; Chemistry; Crystallography; Organometallic chemistry; Crystal structure; Dimer; Ligand (biochemistry); Molecule; Stereochemistry; X-ray crystallography; Diffraction; Physics","authors":[{"name":"Mukarram H. Zaghal","is_ca":false},{"name":"Hanan A. Qaseer","is_ca":false},{"name":"Arab K. El‐Qisairi","is_ca":false},{"name":"Solhe F. Alshahateet","is_ca":false},{"name":"Mazin Y. Shatnawi","is_ca":false},{"name":"Louise N. Dawe","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.005918077922928837,"gpt":0.2456480036891333,"spread":0.2397299257662045,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00006020717,0.00009245992,0.0002295535,0.0001397358,0.0003332642,0.0005442176,0.0004897987,0.0002643039,0.003961754],"category_scores_gemma":[0.0001272985,0.0001087248,0.00007114698,0.0001288005,0.0002681705,0.0002518933,0.0001213588,0.0003689336,0.0003138495],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0006868803,"about_ca_system_score_gemma":0.000419957,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.003129351,"about_ca_topic_score_gemma":0.00328168,"domain_scores_codex":[0.9999604,0.00000614779,0.000001422389,0.000008308492,0.00001107429,0.00001265283],"domain_scores_gemma":[0.9999605,0.00001280154,0.000006186579,0.000004736548,0.000006493442,0.000009296628],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.001992356,0.0004119929,0.001638987,0.0004718129,0.00006688201,0.001420374,0.0005670038,0.01926798,0.8906873,0.05911088,0.00780286,0.01656154],"study_design_scores_gemma":[0.0004833027,0.001871135,0.008222905,0.00004420346,0.0000663172,0.0006414032,0.0003791194,0.07544516,0.8752571,0.004092878,0.03338078,0.000115703],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.979928,0.0009330401,0.002425346,0.0004879927,0.00006163657,0.00001955972,0.001156694,0.0001539552,0.01483371],"genre_scores_gemma":[0.9963899,0.0001759265,0.0006211392,0.00002600373,0.000002910113,0.000005398645,0.0004722742,0.000009052125,0.002297275],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003961754,"threshold_uncertainty_score":0.01325333,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4407104696","doi":"10.3390/chemistry7010018","title":"Pyrrolizine- and Indolizine-Derived Spirooxindoles: Synthesis, Antibacterial Activity and Inverse Docking Analysis","year":2025,"lang":"en","type":"article","venue":"Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":2,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Saskatchewan","funders":"Universidad del Valle","keywords":"Indolizine; Docking (animal); Inverse; Combinatorial chemistry; Computer science; Mathematics; Chemistry; Stereochemistry; Medicine; Veterinary medicine","authors":[{"name":"Pablo Romo","is_ca":false},{"name":"María del Pilar Crespo-Ortiz","is_ca":false},{"name":"Mauricio Barreto","is_ca":false},{"name":"María Elena Burbano","is_ca":false},{"name":"Melissa Mejia-Gutierrez","is_ca":true},{"name":"Jairo Quiroga","is_ca":false},{"name":"Rodrigo Abonı́a","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.008842722586031384,"gpt":0.2352653919137462,"spread":0.2264226693277148,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001429928,0.0003703624,0.0004379045,0.0002579489,0.0001006946,0.0002068601,0.0003009903,0.0002006962,0.001060475],"category_scores_gemma":[0.0001131403,0.0001365818,0.0003223179,0.0002674481,0.0001119677,0.0002142304,0.000165863,0.0003908007,0.0003691352],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002724994,"about_ca_system_score_gemma":0.000194185,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0009295607,"about_ca_topic_score_gemma":0.001093488,"domain_scores_codex":[0.9999321,0.000007488382,0.000004321397,0.00001401911,0.00002262053,0.00001949485],"domain_scores_gemma":[0.9999702,0.000003258877,0.000008275149,0.000002514399,0.000008581085,0.000007253921],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.000485436,0.0002776487,0.00077338,0.000637207,0.00005654741,0.0004584426,0.000111108,0.01412909,0.952766,0.001993021,0.0006327851,0.02767927],"study_design_scores_gemma":[0.0002318823,0.002979439,0.004738235,0.00004029211,0.0001117754,0.0006874746,0.000100879,0.03464086,0.9366644,0.0005156773,0.01918588,0.0001031859],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9665191,0.007470618,0.01733812,0.0002184033,0.00003674507,0.0001828681,0.001165404,0.0001993742,0.006869265],"genre_scores_gemma":[0.9735835,0.004782971,0.01635876,0.00005486485,0.000008299381,0.0001082392,0.001602045,0.00002175704,0.003479527],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001060475,"threshold_uncertainty_score":0.003547668,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3174359129","doi":"10.1016/j.molstruc.2021.130998","title":"Experimental and computational structural studies of 5-substituted-3-(1-arylmethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indoles","year":2021,"lang":"en","type":"article","venue":"Journal of Molecular Structure","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":2,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"","funders":"Institut de Cardiologie de Montréal; China Scholarship Council; Narodowe Centrum Nauki","keywords":"Chemistry; Moiety; Dihedral angle; Hydrogen bond; Crystal structure; Molecule; Indole test; Crystallography; Stereochemistry; Intermolecular force; Supramolecular chemistry; Organic chemistry","authors":[{"name":"Agata Bartyzel","is_ca":false},{"name":"Magda Kondej","is_ca":false},{"name":"Piotr Stępnicki","is_ca":false},{"name":"Tomasz M. Wróbel","is_ca":false},{"name":"Agnieszka A. Kaczor","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01395763054148559,"gpt":0.2842746034101094,"spread":0.2703169728686238,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0005253044,0.0009978879,0.001217266,0.0006157436,0.0007997311,0.0007226762,0.002152005,0.001237035,0.008817525],"category_scores_gemma":[0.0006901408,0.00044377,0.001166272,0.0009247481,0.0006895034,0.0008015445,0.0003555657,0.0008224754,0.0007241923],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0009570367,"about_ca_system_score_gemma":0.001040451,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.009227269,"about_ca_topic_score_gemma":0.01432742,"domain_scores_codex":[0.9997447,0.0000442267,0.00001236376,0.00004729805,0.00007138865,0.00008001069],"domain_scores_gemma":[0.9996101,0.0001873679,0.0000522875,0.00003283994,0.0000869624,0.00003043409],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"simulation_or_modeling","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.0007175978,0.0004730637,0.005987224,0.001212824,0.0001278089,0.0008573019,0.00007656188,0.9590492,0.009805548,0.005501798,0.006747505,0.009443483],"study_design_scores_gemma":[0.0002200359,0.0004553974,0.001866479,0.00003903805,0.00006736113,0.0001101911,0.0001772613,0.9877792,0.005030735,0.00140599,0.002817248,0.00003119368],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.955295,0.003052958,0.007424891,0.0006512197,0.0001096528,0.000105001,0.008760452,0.0006050192,0.02399572],"genre_scores_gemma":[0.9813421,0.0008038953,0.009465397,0.000152178,0.00003102109,0.0001396706,0.006475273,0.0000882665,0.001502279],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.009227269,"threshold_uncertainty_score":0.02949756,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3176921953","doi":"10.4236/ijoc.2021.112006","title":"Novel Tandem Three Consecutive Reactions: Aza-Wittig, Imine Condensation and Electrophilic Aromatic Substitution Strategy to Indolizine Synthesis","year":2021,"lang":"en","type":"article","venue":"International Journal of Organic Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":2,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Université de Moncton","funders":"Universidad Autónoma del Estado de México","keywords":"Imine; Wittig reaction; Electrophilic substitution; Electrophile; Chemistry; Indolizine; Tandem; Electrophilic aromatic substitution; Condensation reaction; Medicinal chemistry; Aryl; Cascade reaction; Combinatorial chemistry; Organic chemistry; Alkyl; Catalysis; Materials science","authors":[{"name":"Julio C. González-Rodríguez","is_ca":false},{"name":"Carlos González‐Romero","is_ca":false},{"name":"Erick Cuevas‐Yáñez","is_ca":false},{"name":"Juan J. Mejía Vega","is_ca":false},{"name":"Christopher K. Jankowski","is_ca":true},{"name":"David Corona‐Becerril","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01930142725811231,"gpt":0.2536824385431843,"spread":0.234381011285072,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002272472,0.000762315,0.0005308355,0.0003992275,0.0002469723,0.0003471174,0.0006984137,0.0004743419,0.001773912],"category_scores_gemma":[0.0001501286,0.0002291424,0.0003448819,0.0003466908,0.0003105285,0.0006764505,0.0005242317,0.000860753,0.0008671155],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003057929,"about_ca_system_score_gemma":0.0003884657,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000271036,"about_ca_topic_score_gemma":0.0006978026,"domain_scores_codex":[0.9997845,0.00002255546,0.00001721141,0.00005663081,0.00003955723,0.00007954095],"domain_scores_gemma":[0.9999347,0.000006328604,0.00001996883,0.00001187212,0.000009621499,0.0000174863],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0001507337,0.0001269568,0.0002573408,0.0002344505,0.00005188177,0.0006774946,0.0001323745,0.0006398008,0.9778555,0.002483036,0.0003221285,0.01706828],"study_design_scores_gemma":[0.00003376515,0.0005250318,0.0006379201,0.000005921346,0.00003712765,0.0007076765,0.00001767349,0.0008159457,0.9903334,0.0002289556,0.006634962,0.00002167318],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9143092,0.005725918,0.05597186,0.000390821,0.0002465378,0.0006060919,0.000583069,0.0009524534,0.02121404],"genre_scores_gemma":[0.9764589,0.001691843,0.01478616,0.00007388749,0.00002836226,0.0001684121,0.0002647863,0.00004309745,0.006484584],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001773912,"threshold_uncertainty_score":0.005934358,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2051192371","doi":"10.1107/s0108270199013049","title":"Racemic isopropyl 1,4-dihydro-2,6-dimethyl-4-(6-methyl-2-pyridyl)-3-nitropyridine-5-carboxylate hemibenzene solvate","year":2000,"lang":"en","type":"article","venue":"Acta Crystallographica Section C Crystal Structure Communications","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":1,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Alberta","funders":"","keywords":"Chemistry; Ring (chemistry); Intramolecular force; Planarity testing; Isopropyl; Stereochemistry; Dihydropyridine; Alkane stereochemistry; Carboxylate; Hydrogen bond; Medicinal chemistry; Molecule; Crystallography; Crystal structure; Organic chemistry; Calcium","authors":[{"name":"Jonathan C. Parrish","is_ca":true},{"name":"Rudong Shan","is_ca":true},{"name":"Edward E. Knaus","is_ca":true},{"name":"Michael N.G. James","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01264837023985017,"gpt":0.2387162481212893,"spread":0.2260678778814392,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001557728,0.0003291251,0.0002512922,0.0001604451,0.0001654185,0.0001353666,0.0002260776,0.0001943942,0.005716904],"category_scores_gemma":[0.00008934405,0.0001072761,0.000087074,0.0001101363,0.0001917682,0.0001830354,0.0001372974,0.000219136,0.001379284],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001748308,"about_ca_system_score_gemma":0.0002822301,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004065527,"about_ca_topic_score_gemma":0.0006261268,"domain_scores_codex":[0.999898,0.00001119437,0.000003501267,0.00002725202,0.00002516932,0.0000350325],"domain_scores_gemma":[0.9999461,0.00001190963,0.00001229114,0.000008275028,0.00001110126,0.0000102759],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0001438304,0.000007301438,0.00004938769,0.00003862299,0.000003777111,0.0000369573,0.00001665303,0.00003978036,0.9977102,0.0002066639,0.0001077038,0.00163909],"study_design_scores_gemma":[0.00002257267,0.0001694386,0.0005080614,0.000002901329,0.000007896571,0.0001008355,0.00001209512,0.0001686833,0.9947949,0.00003432251,0.00417465,0.000003658024],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9490247,0.002498428,0.01776203,0.0002218537,0.0001860793,0.0001122083,0.001344348,0.0004633642,0.0283869],"genre_scores_gemma":[0.9712494,0.001502191,0.004637448,0.00007170905,0.00003363007,0.00007080026,0.001380356,0.0001071796,0.02094736],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.005716904,"threshold_uncertainty_score":0.01912493,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W253903576","doi":"10.1107/s160053680301924x","title":"{2,6-Bis[(4<i>R</i>)-(+)-4-isopropyl-4,5-dihydro-1,3-oxazol-2-yl]pyridine-κ<sup>3</sup><i>N</i>}dichlorozinc(II)","year":2003,"lang":"he","type":"article","venue":"Acta Crystallographica Section E Structure Reports Online","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":1,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Toronto","funders":"","keywords":"Trigonal bipyramidal molecular geometry; Chemistry; Isopropyl; Pyridine; Bipyramid; Ligand (biochemistry); Crystallography; Pentagonal bipyramidal molecular geometry; Oxazoline; Stereochemistry; Crystal structure; Medicinal chemistry; Organic chemistry; Receptor","authors":[{"name":"Francis B. Panosyan","is_ca":true},{"name":"Alan J. Lough","is_ca":true},{"name":"Jik Chin","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.008532658027980044,"gpt":0.2263665413111831,"spread":0.2178338832832031,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00005708309,0.0002354715,0.0002743254,0.0001243499,0.0001609905,0.0002417631,0.0005343602,0.0001290273,0.002049702],"category_scores_gemma":[0.0000712533,0.0001100631,0.00006067952,0.0001573144,0.0001969838,0.0001394322,0.0002117252,0.0001851841,0.0006595703],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004540456,"about_ca_system_score_gemma":0.0002325899,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001415603,"about_ca_topic_score_gemma":0.002549783,"domain_scores_codex":[0.9999106,0.00001090097,0.00000435685,0.00003104134,0.00001755636,0.00002547342],"domain_scores_gemma":[0.9999659,0.000003611597,0.00001005395,0.000003408654,0.000004345803,0.00001282647],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0007628553,0.00003464524,0.0002519905,0.0002756456,0.00001265741,0.0001349857,0.00003231294,0.00033128,0.9855818,0.001155496,0.0009169742,0.01050935],"study_design_scores_gemma":[0.0001105229,0.0004250019,0.001710239,0.0000089507,0.00001578383,0.0003916594,0.00003521772,0.0005757178,0.9809506,0.0001187884,0.01564541,0.0000120869],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9490125,0.003978857,0.01036862,0.0001621957,0.0001422996,0.0001073349,0.001082346,0.0009035323,0.03424231],"genre_scores_gemma":[0.9900136,0.0009487669,0.002511905,0.0000507746,0.0000119752,0.00003839825,0.0005705077,0.00003600517,0.005818149],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002049702,"threshold_uncertainty_score":0.006856978,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4366472721","doi":"10.1139/cjc-2023-0005","title":"Synthesis of novel 2- and 8-substituted 4-amino-7-chloroquinolines and their <i>N</i>-alkylated coupling products","year":2023,"lang":"en","type":"article","venue":"Canadian Journal of Chemistry","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":1,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":true,"about_ca":false},"ca_institutions":"CanAm Bioresearch (Canada); University of Manitoba; Children's Hospital Research Institute of Manitoba","funders":"Research Manitoba","keywords":"Chemistry; Alkylation; Yield (engineering); Quinoline; Pyrrole; Nuclear magnetic resonance spectroscopy; Stereochemistry; Ketone; Mass spectrometry; Crystal structure; Medicinal chemistry; Crystallography; Organic chemistry","authors":[{"name":"Dion B. Nemez","is_ca":true},{"name":"Baldeep K. Sidhu","is_ca":true},{"name":"Kevin P. Carlin","is_ca":true},{"name":"Albert D. Friesen","is_ca":true},{"name":"David E. Herbert","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.02005686589380225,"gpt":0.2075956300146374,"spread":0.1875387641208351,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000114658,0.0004403317,0.0002741084,0.0001685976,0.0001478118,0.0001273289,0.0004208545,0.0003068738,0.001721643],"category_scores_gemma":[0.0001146478,0.0001465443,0.0001796139,0.000167396,0.0001313109,0.0002146029,0.0002027923,0.0003140862,0.0006804622],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00022671,"about_ca_system_score_gemma":0.0002791492,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005061219,"about_ca_topic_score_gemma":0.001619464,"domain_scores_codex":[0.9999024,0.00001687892,0.000008011658,0.00001774921,0.00002371848,0.00003128538],"domain_scores_gemma":[0.9999434,0.000007197977,0.00001527399,0.000006649776,0.00001276171,0.0000147769],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0001244542,0.00005470334,0.0001567384,0.0003021739,0.0000203802,0.0003412766,0.00008105752,0.0006848141,0.9828909,0.0006854355,0.0002273772,0.01443069],"study_design_scores_gemma":[0.00004884724,0.001154454,0.001259841,0.00001967954,0.00002618729,0.0006361326,0.0000295094,0.0006618247,0.9758561,0.0001435539,0.02014385,0.00002006479],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9406492,0.01208121,0.02664284,0.0001809479,0.0001409224,0.000369317,0.001069593,0.0003099354,0.01855601],"genre_scores_gemma":[0.965431,0.005515326,0.0205524,0.0001211009,0.00002860718,0.0002125898,0.0008251521,0.00004411852,0.007269664],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001721643,"threshold_uncertainty_score":0.005759478,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4414184086","doi":"10.1039/d5sc04328j","title":"A borindolizine platform for the design of fluorophores with tunable emissions","year":2025,"lang":"en","type":"article","venue":"Chemical Science","topic":"Synthesis and Reactivity of Heterocycles","field":"Chemistry","cited_by":1,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Toronto","funders":"Natural Sciences and Engineering Research Council of Canada; Vetenskapsrådet","keywords":"Rational design; Fluorescence; Scaffold; Spectral properties; Aryl; Power (physics)","authors":[{"name":"Chirag Apte","is_ca":true},{"name":"Nicholas W. Heller","is_ca":true},{"name":"Ben Zhen Huang","is_ca":true},{"name":"Adam Marr","is_ca":true},{"name":"Kjell Jorner","is_ca":true},{"name":"Alán Aspuru‐Guzik","is_ca":true},{"name":"Andrei K. Yudin","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.02491266643242009,"gpt":0.270387280350837,"spread":0.2454746139184169,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001751976,0.000226915,0.0001110047,0.0001965121,0.0001450664,0.0002547187,0.000264669,0.0002646594,0.002159816],"category_scores_gemma":[0.0001176065,0.0001170697,0.0001232754,0.0001721054,0.0001973014,0.0003061433,0.0003538725,0.0005157703,0.00060532],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003536685,"about_ca_system_score_gemma":0.0002648924,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002728816,"about_ca_topic_score_gemma":0.0005489712,"domain_scores_codex":[0.999945,0.000006107538,0.000003366424,0.0000143532,0.00001546772,0.00001571715],"domain_scores_gemma":[0.9999713,0.00000548813,0.000007248037,0.000003947173,0.000004534875,0.000007477779],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00008917838,0.00006102113,0.0001407351,0.0001321194,0.000009615149,0.0001185446,0.00005100277,0.0009326417,0.9722282,0.009247165,0.0005007289,0.01648907],"study_design_scores_gemma":[0.00007119371,0.0004584041,0.0004898201,0.00001844942,0.00001399724,0.0002841249,0.00002097089,0.00261529,0.9643955,0.00126769,0.03034445,0.00002012687],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8334102,0.003825018,0.123566,0.001210252,0.0002207143,0.0004250677,0.0009716001,0.0008103809,0.03556075],"genre_scores_gemma":[0.954814,0.00159204,0.03570149,0.0002299328,0.00001298721,0.000167204,0.0004778027,0.0000420641,0.006962399],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002159816,"threshold_uncertainty_score":0.007225275,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null}]}