{"meta":{"page":1,"per_page":50,"max_per_page":100,"total":792,"total_is_capped":false,"direct_labels_cover":0,"predictions_cover":792,"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"},"query_hash":"646ffe0140e5","filters":{"venue":"Chemical Science"}},"results":[{"id":"W2211195160","doi":"10.1039/c5sc03224e","title":"The rise of 3-d single-ion magnets in molecular magnetism: towards materials from molecules?","year":2015,"lang":"en","type":"article","venue":"Chemical Science","topic":"Magnetism in coordination complexes","field":"Materials Science","cited_by":618,"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; KU Leuven; National High Magnetic Field Laboratory; University of Ottawa","keywords":"Magnetism; Magnet; Spin (aerodynamics); Ion; Molecule; Single-molecule magnet; Molecular magnets; Process (computing); Materials science; Nanotechnology; Chemical physics; Chemistry; Physics; Condensed matter physics; Computer science; Magnetization; Magnetic field; Quantum mechanics","retraction":null,"screen_n_in":null,"score":{"opus":0.02580167017613108,"gpt":0.2655518736129273,"spread":0.2397502034367962,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.001519159,0.0001571252,0.0002236754,0.00007707345,0.00007913237,0.0002236113,0.00137899,0.00007122165,0.0005343999],"category_scores_gemma":[0.001478193,0.0001187304,0.00003053859,0.0006467485,0.001456863,0.0002797466,0.0005235574,0.00007759065,0.00008159758],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001397849,"about_ca_system_score_gemma":0.0001794018,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005723216,"about_ca_topic_score_gemma":0.00001495546,"domain_scores_codex":[0.9974832,0.0001230517,0.0004697957,0.0004994575,0.0009656662,0.0004588145],"domain_scores_gemma":[0.9987096,0.0001424351,0.000178245,0.0005234335,0.000243689,0.0002026298],"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":[0.00002895285,0.00004905615,0.00004105351,0.000005190255,3.416111e-7,0.000007174244,0.000131236,0.00001347789,0.9952663,0.001162561,0.0002416337,0.003053027],"study_design_scores_gemma":[0.0003126033,0.00008494243,0.0007870108,0.0000234129,0.000003666567,0.000004116015,0.00005186141,0.0003004898,0.9871768,0.01015743,0.0009487398,0.0001489052],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9934971,0.0003747231,0.0005614983,0.0008423048,0.0005940667,0.0001947579,0.00002922356,0.00004225711,0.003864108],"genre_scores_gemma":[0.991473,0.000006153868,0.008293012,0.00007055785,0.00005234421,0.00002422214,0.000003194212,0.00001020199,0.00006728967],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.008994865,"threshold_uncertainty_score":0.5851305,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2163915517","doi":"10.1039/c4sc03759f","title":"Combination of Ru(<scp>ii</scp>) complexes and light: new frontiers in cancer therapy","year":2015,"lang":"en","type":"article","venue":"Chemical Science","topic":"Metal complexes synthesis and properties","field":"Medicine","cited_by":554,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Institute of Cancer Research","funders":"Universität Zürich; Schweizerischer Nationalfonds zur Förderung der Wissenschaftlichen Forschung; National Science Foundation","keywords":"Cancer therapy; Cancer; Chemistry; Cancer research; Medicine; Internal medicine","retraction":null,"screen_n_in":null,"score":{"opus":0.0814565347575761,"gpt":0.3034351200303325,"spread":0.2219785852727564,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0003075064,0.00007021533,0.0002070377,0.00007035212,0.00003471563,0.00001406387,0.0001360782,0.00003091468,0.000006608239],"category_scores_gemma":[0.0003514464,0.00004745221,0.00001943124,0.0003277581,0.0003648578,0.0001115914,0.00006168207,0.00006543105,0.000001109164],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00005164421,"about_ca_system_score_gemma":0.0001637103,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002113243,"about_ca_topic_score_gemma":0.000003531884,"domain_scores_codex":[0.9991915,0.00001189078,0.0001479418,0.0001813314,0.0003081771,0.0001591204],"domain_scores_gemma":[0.9995456,0.0000302202,0.00004733231,0.000112329,0.00008290719,0.0001816406],"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":[0.00002403434,0.00006109312,0.0157248,0.00001375939,0.000003346374,3.307877e-7,0.001103416,4.597989e-7,0.9702193,0.0002507951,0.003744415,0.008854294],"study_design_scores_gemma":[0.0006844065,0.0001248028,0.01193384,0.00006010999,0.0000049708,0.000002722916,0.0002234318,0.0004227577,0.9768547,0.002059394,0.007596322,0.00003255652],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9919677,0.003784186,0.00003722085,0.0009309846,0.00009571019,0.000118352,8.449275e-7,0.00001026102,0.003054746],"genre_scores_gemma":[0.9976254,0.0001430039,0.001597933,0.0001779307,0.00003173148,0.000004510659,8.211572e-7,0.000003955302,0.0004147714],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.008821737,"threshold_uncertainty_score":0.1935045,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2113450820","doi":"10.1039/c4sc03089c","title":"Macrocycles: lessons from the distant past, recent developments, and future directions","year":2014,"lang":"en","type":"article","venue":"Chemical Science","topic":"Chemical Synthesis and Analysis","field":"Biochemistry, Genetics and Molecular Biology","cited_by":488,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Toronto; Toronto Public Health","funders":"Canadian Institutes of Health Research; Québec Consortium for Drug Discovery; Natural Sciences and Engineering Research Council of Canada; Université de Sherbrooke; GlaxoSmithKline; University of Toronto; AstraZeneca","keywords":"The Renaissance; Nanotechnology; Cognitive science; Computer science; Combinatorial chemistry; Chemistry; Psychology; Materials science; History","retraction":null,"screen_n_in":null,"score":{"opus":0.007334368554090918,"gpt":0.2417139205905678,"spread":0.2343795520364769,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001688581,0.00008886291,0.00008374902,0.000007384492,0.0002206314,0.00005880198,0.0002939618,0.00005420382,0.00002949004],"category_scores_gemma":[0.0001399369,0.00005497277,0.00003705244,0.0002068065,0.000389475,0.0000037542,0.0001952102,0.00006495004,0.0000040737],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00001900587,"about_ca_system_score_gemma":0.00002706795,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001898771,"about_ca_topic_score_gemma":0.00001095333,"domain_scores_codex":[0.9991494,0.00001452791,0.0001054801,0.0003768086,0.0001569107,0.0001968912],"domain_scores_gemma":[0.9995441,0.00003354228,0.00003404738,0.0002265264,0.00004117005,0.0001205497],"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":[0.000003853801,0.00001603407,0.001043761,8.011913e-7,0.000007275524,7.099113e-8,0.00002392142,7.752604e-8,0.9126002,0.00009633335,0.0005294381,0.08567829],"study_design_scores_gemma":[0.00004999461,0.000003041061,0.003148569,0.000003960543,0.00000864551,0.000001054646,0.00004324967,0.00001825505,0.5338729,0.0001966268,0.4625789,0.00007478951],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9908071,0.0007325343,0.000296244,0.006562555,0.00007795571,0.00003948695,0.00001186402,0.00001054105,0.001461782],"genre_scores_gemma":[0.9969877,0.001187338,0.0007925692,0.0004437394,0.0005122591,0.000008311029,0.00002426899,0.00000497045,0.00003882316],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.4620495,"threshold_uncertainty_score":0.2241725,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2022481226","doi":"10.1039/c4sc00395k","title":"Frustrated Lewis pair chemistry of carbon, nitrogen and sulfur oxides","year":2014,"lang":"en","type":"article","venue":"Chemical Science","topic":"Organoboron and organosilicon chemistry","field":"Chemistry","cited_by":468,"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":"Frustrated Lewis pair; Chemistry; Sulfur; Lewis acids and bases; Nitrogen; Carbon fibers; Molecule; Organic chemistry; Catalysis; Materials science","retraction":null,"screen_n_in":null,"score":{"opus":0.007558762269248344,"gpt":0.2130125212070562,"spread":0.2054537589378078,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002397964,0.0002096671,0.0002638531,0.0000179931,0.00007425161,0.00004460432,0.0005870081,0.0001914934,0.0005585813],"category_scores_gemma":[0.0005478917,0.0001967268,0.00005139396,0.0003650887,0.001372734,0.00009057474,0.0002242373,0.0002312343,0.000004592226],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00006997768,"about_ca_system_score_gemma":0.0001378032,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00003791564,"about_ca_topic_score_gemma":5.304962e-7,"domain_scores_codex":[0.9982792,0.000004889468,0.0003043176,0.0005743735,0.0004019211,0.0004353055],"domain_scores_gemma":[0.9988526,0.00008449459,0.0001220497,0.0004635704,0.0001239256,0.0003534061],"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":[0.000007300494,0.00004218251,0.02164077,0.0001643717,0.000005713232,0.000001289432,0.00004500542,2.234902e-7,0.9769639,0.00002601681,0.00004810262,0.001055064],"study_design_scores_gemma":[0.0003025898,0.000004915699,0.0002114489,0.0000388872,0.00001478035,0.00002509621,0.0000958751,0.0002110253,0.9981801,0.0003645236,0.0003195479,0.0002312049],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9811673,0.0001425584,0.000002146744,0.0001560574,0.00001990662,0.00002217933,0.000008402225,0.0001007338,0.01838072],"genre_scores_gemma":[0.999483,0.00001293395,0.0001806319,0.00004283985,0.0001109022,0.000004165266,0.000006234102,0.0000170656,0.0001421551],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.02142932,"threshold_uncertainty_score":0.8022288,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2103034037","doi":"10.1039/c5sc02678d","title":"Accurate calculation of the absolute free energy of binding for drug molecules","year":2015,"lang":"en","type":"article","venue":"Chemical Science","topic":"Protein Structure and Dynamics","field":"Biochemistry, Genetics and Molecular Biology","cited_by":398,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"","funders":"Imperial College London; Ministero dello Sviluppo Economico; University of Southampton; Ontario Ministry of Economic Development and Innovation; Engineering and Physical Sciences Research Council; Genome Canada; Wellcome Trust; Wellcome; University of California, Irvine; GlaxoSmithKline; Eli Lilly and Company","keywords":"Molecule; Absolute (philosophy); Energy (signal processing); Computational chemistry; Drug; Chemistry; Mathematics; Medicine; Statistics; Pharmacology; Organic chemistry; Epistemology; Philosophy","retraction":null,"screen_n_in":null,"score":{"opus":0.01227780623073879,"gpt":0.2559389484554257,"spread":0.2436611422246869,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000155917,0.00004786279,0.00006042942,0.0000124493,0.00002853269,0.000005344673,0.0004210709,0.000041449,3.939573e-7],"category_scores_gemma":[0.0003763534,0.00003239946,0.00004357001,0.0001459975,0.0003146484,0.000004187637,0.0002007284,0.00001935799,7.516697e-8],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00001119263,"about_ca_system_score_gemma":0.0001072954,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001829507,"about_ca_topic_score_gemma":0.000005475149,"domain_scores_codex":[0.9994866,0.000006429932,0.0001089181,0.000141752,0.0001448289,0.0001114523],"domain_scores_gemma":[0.9994844,0.000007854972,0.00008559594,0.0002477556,0.0001292301,0.00004521601],"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":[0.00001368667,0.000004791722,0.00009717685,0.000005002192,0.000001876432,2.214922e-8,0.00001929925,0.00007077684,0.9978764,0.001332775,0.000243692,0.000334521],"study_design_scores_gemma":[0.0001598389,0.00001802667,0.0001501117,0.000006030226,0.000003970219,0.000001088444,0.000009623014,0.001968404,0.9945588,0.00261056,0.0004695123,0.00004402527],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9856051,0.0000714208,0.01364468,0.00007640305,0.0000747441,0.00006276374,0.00001565377,0.000002082815,0.0004471878],"genre_scores_gemma":[0.997345,0.000002617926,0.00250267,0.00003613153,0.00003349522,0.000004653426,0.0000083032,0.000003074024,0.00006399926],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01173999,"threshold_uncertainty_score":0.1321212,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W1987145056","doi":"10.1039/c4sc00469h","title":"Dynamics of photogenerated holes in undoped BiVO<sub>4</sub> photoanodes for solar water oxidation","year":2014,"lang":"en","type":"article","venue":"Chemical Science","topic":"Advanced Photocatalysis Techniques","field":"Energy","cited_by":377,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Kensington Health","funders":"European Science Foundation; European Commission; Schweizerischer Nationalfonds zur Förderung der Wissenschaftlichen Forschung; National Science Foundation","keywords":"Limiting; Ultrafast laser spectroscopy; Recombination; Materials science; Redox; Dynamics (music); Electron; Absorption (acoustics); Chemical physics; Photochemistry; Spectroscopy; Electron transfer; Optoelectronics; Chemistry; Inorganic chemistry; Physics","retraction":null,"screen_n_in":null,"score":{"opus":0.01075440193890216,"gpt":0.2541237380979426,"spread":0.2433693361590405,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0005409549,0.0001418339,0.0002276116,0.0001473971,0.0000644697,0.0000284056,0.0004648197,0.0000932842,0.000007904977],"category_scores_gemma":[0.0003281014,0.0001114465,0.00005660976,0.0006094138,0.0006001171,0.0002733686,0.0001161496,0.00008671403,0.000006600956],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001800458,"about_ca_system_score_gemma":0.0000342659,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00008781035,"about_ca_topic_score_gemma":0.0001231928,"domain_scores_codex":[0.9986011,0.00002118087,0.0003209349,0.0004194152,0.0002570875,0.000380265],"domain_scores_gemma":[0.9992546,0.00008033815,0.00008791254,0.0003360469,0.0001631703,0.00007788069],"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":[0.00002663887,0.00004962086,0.0001067013,0.00001784576,0.000002251173,1.827627e-7,0.00005487748,0.0002799855,0.9933162,0.001625233,0.000007295757,0.004513138],"study_design_scores_gemma":[0.0002587764,0.00002518906,0.00002586081,0.00002275007,0.000006299368,8.834273e-7,0.00001239293,0.0391496,0.9489061,0.011318,0.0001168564,0.0001573321],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9721138,0.000004888198,0.02704712,0.00004221772,0.0000315542,0.0002713474,0.000005805519,0.00008333157,0.000399936],"genre_scores_gemma":[0.9929284,0.00000626297,0.006740538,0.00006569444,0.00002037734,0.0001144754,0.00009743893,0.00001735383,0.000009410921],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.04441017,"threshold_uncertainty_score":0.4544658,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3015120794","doi":"10.1039/d0sc00712a","title":"Recent advances in photoredox and nickel dual-catalyzed cascade reactions: pushing the boundaries of complexity","year":2020,"lang":"en","type":"review","venue":"Chemical Science","topic":"Radical Photochemical Reactions","field":"Chemistry","cited_by":354,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Kootenay Association for Science & Technology","funders":"King Abdullah University of Science and Technology","keywords":"Cascade; Dual (grammatical number); Catalysis; Nickel; Combinatorial chemistry; Computer science; Chemistry; Organic chemistry; Philosophy","retraction":null,"screen_n_in":null,"score":{"opus":0.05862964903323364,"gpt":0.3488170732206569,"spread":0.2901874241874233,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["sts"],"consensus_categories":[],"category_scores_codex":[0.0004140426,0.0003591407,0.001084024,0.00006948271,0.0002977301,0.0001926424,0.0009555853,0.0002624564,0.0001549764],"category_scores_gemma":[0.004913067,0.0002444981,0.0001936225,0.001400756,0.007394739,0.00037759,0.0004961308,0.001268311,0.00001034152],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005555915,"about_ca_system_score_gemma":0.0008191296,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00008236697,"about_ca_topic_score_gemma":0.00001760954,"domain_scores_codex":[0.9970883,0.0000314104,0.0008841225,0.0008298798,0.0006967937,0.0004694733],"domain_scores_gemma":[0.9976124,0.0009287833,0.0004884035,0.0005691806,0.00008004175,0.0003211653],"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":[0.00001497667,0.0001047603,0.000002357301,0.00476895,0.00002387833,0.00001014213,0.0001334576,1.186261e-7,0.1217732,0.0007083491,0.0001361141,0.8723237],"study_design_scores_gemma":[0.0001041711,0.000003078435,6.435095e-7,0.002568061,0.00007615117,0.00008006905,0.00005892628,0.00003046323,0.04207341,0.001019708,0.9537387,0.0002466009],"study_design_candidate":"not_applicable","study_design_consensus":null,"genre_codex":"review","genre_gemma":"review","genre_scores_codex":[0.00103466,0.9917298,0.000003321869,0.0003019319,0.00011491,0.0003129106,0.00008442978,0.00005088628,0.006367158],"genre_scores_gemma":[0.0004525081,0.998924,0.0002590838,0.00002887285,0.000107785,0.0001304481,0.00004084397,0.00002254142,0.00003394589],"genre_candidate":"review","genre_consensus":"review","teacher_disagreement_score":0.9536026,"threshold_uncertainty_score":0.9970343,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4313880353","doi":"10.1039/d2sc05709c","title":"AlphaFold accelerates artificial intelligence powered drug discovery: efficient discovery of a novel CDK20 small molecule inhibitor","year":2023,"lang":"en","type":"article","venue":"Chemical Science","topic":"Computational Drug Discovery Methods","field":"Computer Science","cited_by":326,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Vector Institute; Canadian Institute for Advanced Research","funders":"National Institute of General Medical Sciences","keywords":"Drug discovery; Small molecule; Computational biology; Molecule; Combinatorial chemistry; Virtual screening; Chemistry; Nanotechnology; Computer science; Biology; Biochemistry; Materials science","retraction":null,"screen_n_in":null,"score":{"opus":0.0524001161365023,"gpt":0.3157714170822931,"spread":0.2633713009457908,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.001580947,0.0003025023,0.0003608844,0.0003776059,0.0002105969,0.0008345085,0.003111717,0.00006819842,0.000005219382],"category_scores_gemma":[0.00108986,0.0002696118,0.0001815449,0.005583257,0.001005376,0.001523549,0.002269822,0.0002476042,0.00005097932],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001820013,"about_ca_system_score_gemma":0.000642909,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00005157195,"about_ca_topic_score_gemma":0.000003546397,"domain_scores_codex":[0.9959142,0.00006486496,0.0006831285,0.001220661,0.001299332,0.0008177845],"domain_scores_gemma":[0.9976428,0.0008007991,0.000240916,0.0008147274,0.0002598186,0.0002409034],"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":[0.00002190695,0.0003251084,0.00002838448,0.00002642326,0.000007490401,0.000009132526,0.0006400066,0.02558822,0.8793444,0.08976669,0.00006841905,0.004173819],"study_design_scores_gemma":[0.00007721921,0.0000223077,0.0002315656,0.0000470444,0.000003875964,0.000005123562,0.00007897097,0.3658408,0.6275613,0.005888375,0.00001290042,0.0002305227],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.6299377,0.00003206276,0.3682098,0.0006584295,0.0005254208,0.0001935037,0.0000201298,0.0001422371,0.0002806982],"genre_scores_gemma":[0.9728149,0.000005609779,0.02679591,0.0001318912,0.0001069477,0.0000255925,0.000009435973,0.00001620195,0.00009349121],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.3428772,"threshold_uncertainty_score":0.9999756,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3135156099","doi":"10.1039/d0sc06973f","title":"CRISPR technology incorporating amplification strategies: molecular assays for nucleic acids, proteins, and small molecules","year":2021,"lang":"en","type":"review","venue":"Chemical Science","topic":"CRISPR and Genetic Engineering","field":"Biochemistry, Genetics and Molecular Biology","cited_by":302,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Alberta Hospital Edmonton; University of Alberta","funders":"Social Sciences and Humanities Research Council of Canada; Natural Sciences and Engineering Research Council of Canada; Canadian Institutes of Health Research; Alberta Innovates; China Scholarship Council","keywords":"CRISPR; Nucleic acid; Palindrome; Computational biology; Biology; Genome editing; Genome; Chemistry; Nanotechnology; Genetics; Gene; Materials science","retraction":null,"screen_n_in":null,"score":{"opus":0.02137540916769379,"gpt":0.3416980224268022,"spread":0.3203226132591084,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0003124304,0.0003129296,0.0005050842,0.0001113824,0.0001114269,0.0001435135,0.0005477257,0.0004240242,0.000001351133],"category_scores_gemma":[0.0005126472,0.0002915614,0.000139848,0.0005219649,0.0004456677,0.000006382885,0.0003620614,0.0002003058,0.000001444247],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00003910083,"about_ca_system_score_gemma":0.0004918186,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000001787419,"about_ca_topic_score_gemma":0.000001043855,"domain_scores_codex":[0.9981958,0.00002050826,0.0003512246,0.0009045692,0.000150431,0.0003774427],"domain_scores_gemma":[0.9990098,0.0000218888,0.0001640012,0.0005074686,0.0001680255,0.0001287393],"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":[0.000001649367,0.00002218826,0.000001305703,0.001885438,0.00002106581,0.000003143617,0.000006859793,0.00001073837,0.7896987,0.002043162,0.00003073419,0.2062751],"study_design_scores_gemma":[0.0001833817,0.0001323752,6.836614e-7,0.001642124,0.0001534673,0.00009565908,0.0001234231,0.0001944878,0.5901271,0.0008138675,0.4057961,0.0007373182],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"review","genre_gemma":"review","genre_scores_codex":[0.001136873,0.8410881,0.1568023,0.00004684286,0.00005878383,0.0006859107,0.00002030841,0.00003124503,0.000129675],"genre_scores_gemma":[0.009125595,0.9003945,0.08908416,0.0000429157,0.0001946711,0.0006888582,0.0003566982,0.00008303006,0.00002957034],"genre_candidate":"review","genre_consensus":"review","teacher_disagreement_score":0.4057654,"threshold_uncertainty_score":0.9999536,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2990010612","doi":"10.1039/c9sc03754c","title":"Large scale relative protein ligand binding affinities using non-equilibrium alchemy","year":2019,"lang":"en","type":"article","venue":"Chemical Science","topic":"Protein Structure and Dynamics","field":"Biochemistry, Genetics and Molecular Biology","cited_by":298,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"De Beers (Canada)","funders":"Horizon 2020 Framework Programme; European Commission; Alexander von Humboldt-Stiftung","keywords":"Affinities; Binding affinities; Alchemy; Chemistry; Ligand (biochemistry); Scale (ratio); Stereochemistry; Biochemistry; Receptor; Philosophy; Geography; Cartography","retraction":null,"screen_n_in":null,"score":{"opus":0.007597448507110824,"gpt":0.2458628824779594,"spread":0.2382654339708486,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002198891,0.0001355418,0.0001263798,0.00003811238,0.00009739048,0.00005218302,0.0003662084,0.0001354679,0.00001545309],"category_scores_gemma":[0.00008752681,0.000119353,0.00005645796,0.0002740518,0.0003478862,0.00002798385,0.0003721351,0.0001240796,0.00002360931],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00004032761,"about_ca_system_score_gemma":0.000158166,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000004090563,"about_ca_topic_score_gemma":7.543694e-7,"domain_scores_codex":[0.9987516,0.000008087987,0.0001356745,0.0004556723,0.0002259972,0.0004229408],"domain_scores_gemma":[0.9994515,0.000006803074,0.00006823575,0.0002878588,0.00007291663,0.000112652],"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":[0.00001488315,0.00001253117,0.0009183306,0.00001280455,0.000003999387,7.133535e-7,0.00009606787,0.000006991527,0.9987453,0.0001307763,0.00001003588,0.00004757899],"study_design_scores_gemma":[0.0002552819,0.00004366838,0.00006964785,0.00003257651,0.000004394827,0.000008990616,0.00009504145,0.00208598,0.9964771,0.0003780923,0.0003629641,0.0001862528],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9936907,0.00006271496,0.001817953,0.00003086389,0.00009924381,0.0002553601,0.00001287873,0.00001128487,0.004019018],"genre_scores_gemma":[0.9954032,0.000001976737,0.003928441,0.00007528839,0.00008569301,0.000007287371,0.00001699519,0.00001172911,0.0004693476],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003549671,"threshold_uncertainty_score":0.4867075,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2769162782","doi":"10.1039/c7sc04531j","title":"Tinker-HP: a massively parallel molecular dynamics package for multiscale simulations of large complex systems with advanced point dipole polarizable force fields","year":2017,"lang":"en","type":"article","venue":"Chemical Science","topic":"Quantum, superfluid, helium dynamics","field":"Physics and Astronomy","cited_by":268,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Toronto Metropolitan University","funders":"NIH Office of the Director; Academic Computer Centre Cyfronet, AGH University of Science and Technology; Grand Équipement National De Calcul Intensif; Centre National de la Recherche Scientifique; National Institute of General Medical Sciences; Ministère de la Défense; University of Texas at Austin; Welch Foundation; National Science Foundation; Ministry of Defense; Agence Nationale de la Recherche; Cancer Prevention and Research Institute of Texas; National Institutes of Health","keywords":"Massively parallel; Tinker; Molecular dynamics; Polarizability; Dipole; Point (geometry); Computational science; Computer science; Computational chemistry; Parallel computing; Physics; Chemistry; Molecule","retraction":null,"screen_n_in":null,"score":{"opus":0.01079565028014756,"gpt":0.2807862911894533,"spread":0.2699906409093057,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000162605,0.0001792651,0.0002816007,0.00003623091,0.0004971407,0.0001474302,0.0007702567,0.00005874611,0.00002435828],"category_scores_gemma":[0.0000842274,0.0001542349,0.00008754859,0.0001418748,0.0005104184,0.0003973602,0.0002196794,0.0001425219,0.000004749452],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00008989911,"about_ca_system_score_gemma":0.0001548687,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002470275,"about_ca_topic_score_gemma":0.0000171885,"domain_scores_codex":[0.9984801,0.00001087823,0.0002717343,0.000413405,0.0003033375,0.0005205042],"domain_scores_gemma":[0.998593,0.00009763839,0.0002259298,0.000688766,0.0002267899,0.0001678164],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.0000729411,0.0003183153,0.02622882,0.0001174747,0.00004556284,0.000002501706,0.000250164,0.00844976,0.8264442,0.1373431,0.00005713501,0.0006699728],"study_design_scores_gemma":[0.001284959,0.00008079251,0.001441472,0.00007853163,0.00002780855,0.000001163396,0.0002199373,0.9542783,0.03856651,0.003637824,0.00009862837,0.0002840919],"study_design_candidate":"simulation_or_modeling","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.5456791,0.00001442179,0.4519034,0.0001843156,0.00005590575,0.0004180857,0.0005125392,0.00001848751,0.001213743],"genre_scores_gemma":[0.984552,3.033188e-7,0.01499521,0.00002459928,0.00003609335,0.00004174919,0.0001204245,0.00002004867,0.0002096341],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.9458285,"threshold_uncertainty_score":0.6289516,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2787936482","doi":"10.1039/c7sc04682k","title":"Positional effects of second-sphere amide pendants on electrochemical CO<sub>2</sub> reduction catalyzed by iron porphyrins","year":2018,"lang":"en","type":"article","venue":"Chemical Science","topic":"CO2 Reduction Techniques and Catalysts","field":"Energy","cited_by":267,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"","funders":"UC Berkeley College of Chemistry; Lawrence Berkeley National Laboratory; National Center for Research Resources; Canadian Institute for Advanced Research; University of California Berkeley; U.S. Department of Energy; Howard Hughes Medical Institute; National Institutes of Health; National Science Foundation","keywords":"Electrochemistry; Catalysis; Amide; Electrochemical reduction of carbon dioxide; Reduction (mathematics); Chemistry; Carbon dioxide; Carbon fibers; Coordination sphere; Inorganic chemistry; Combinatorial chemistry; Materials science; Organic chemistry; Electrode; Molecule; Carbon monoxide; Physical chemistry","retraction":null,"screen_n_in":null,"score":{"opus":0.004192228183706982,"gpt":0.2324558176781434,"spread":0.2282635894944364,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001601754,0.0001836151,0.0002025026,0.00007319318,0.0001508918,0.00002950223,0.0004081891,0.000131505,0.000253965],"category_scores_gemma":[0.000157472,0.0001742128,0.00009107113,0.0005969515,0.001146951,0.0002097326,0.0000809343,0.0002058349,0.00006916265],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002809375,"about_ca_system_score_gemma":0.000107947,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00005378724,"about_ca_topic_score_gemma":0.000003636866,"domain_scores_codex":[0.9981596,0.00001867945,0.0002655606,0.0005713982,0.0005612088,0.0004235683],"domain_scores_gemma":[0.9991039,0.0000638454,0.0001322426,0.0003394796,0.0001521532,0.000208389],"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":[0.00006460337,0.0001437027,0.000005224663,0.00002944582,0.000005460122,9.658191e-7,0.00005141508,3.813115e-7,0.9910728,0.0007440069,0.003184,0.004697946],"study_design_scores_gemma":[0.0002542417,0.0001479813,0.0001911519,0.00004409502,0.00001108762,0.00004789913,0.00001280066,0.00003128523,0.9976263,0.0009910638,0.0004449327,0.0001971327],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9958825,0.00003139281,0.0002170057,0.000089041,0.0001511679,0.0001383981,0.00001502851,0.0001266142,0.003348858],"genre_scores_gemma":[0.9992468,0.00001166229,0.0002200022,0.00007284831,0.0002378438,0.0000259526,0.00009915518,0.00001620529,0.00006946629],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.00655348,"threshold_uncertainty_score":0.7104192,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W1974440523","doi":"10.1039/c4sc00312h","title":"Mapping electrogenerated chemiluminescence reactivity in space: mechanistic insight into model systems used in immunoassays","year":2014,"lang":"en","type":"article","venue":"Chemical Science","topic":"Advanced biosensing and bioanalysis techniques","field":"Biochemistry, Genetics and Molecular Biology","cited_by":261,"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":"Chemiluminescence; Reactivity (psychology); Space (punctuation); Chemistry; Combinatorial chemistry; Nanotechnology; Computer science; Materials science; Chromatography; Medicine","retraction":null,"screen_n_in":null,"score":{"opus":0.009600360342039007,"gpt":0.25197396576999,"spread":0.242373605427951,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0007327546,0.000175429,0.0002297419,0.0001348689,0.00006747719,0.00003246721,0.0003702731,0.0001631514,1.968471e-7],"category_scores_gemma":[0.0004857825,0.0001569027,0.00004243632,0.001004333,0.00029733,0.00001522443,0.0001643905,0.0001748978,9.80442e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001545282,"about_ca_system_score_gemma":0.0001183117,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00009118726,"about_ca_topic_score_gemma":0.00002695237,"domain_scores_codex":[0.9984009,0.00004005169,0.0002585832,0.000640161,0.0002441708,0.0004160876],"domain_scores_gemma":[0.9993209,0.00001789492,0.00009144806,0.0003806545,0.0001002316,0.00008881705],"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":[0.00001444578,0.00004839008,0.0005201229,0.00001090341,0.000001902748,0.000001430761,0.00003639725,0.0001100941,0.9987064,0.0002116863,0.000006216788,0.0003320124],"study_design_scores_gemma":[0.0001609594,0.00002415894,0.00005644002,0.00004255854,0.00000220379,0.000006151716,0.00001910248,0.08388091,0.9151828,0.0003414713,0.00008048736,0.0002027565],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9823121,0.00008229959,0.01691604,0.00006391839,0.00002733668,0.00011738,9.94422e-7,0.00003112971,0.0004488331],"genre_scores_gemma":[0.9954357,0.00003323815,0.004373054,0.0000456386,0.00004220536,0.00001619081,0.00001769458,0.00001029754,0.00002599217],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.08377081,"threshold_uncertainty_score":0.6398306,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3132055573","doi":"10.1039/d0sc06878k","title":"Emerging applications for living crystallization-driven self-assembly","year":2021,"lang":"en","type":"review","venue":"Chemical Science","topic":"Advanced Polymer Synthesis and Characterization","field":"Chemistry","cited_by":243,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Victoria","funders":"Natural Sciences and Engineering Research Council of Canada; Shanghai Jiao Tong University; East China University of Science and Technology; Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences; Chinese Academy of Sciences","keywords":"Supramolecular chemistry; Dispersity; Nanotechnology; Polymer; Supramolecular polymers; Nanomedicine; Materials science; Self-assembly; Crystallization; Nanoparticle; Amphiphile; Micelle; Chemical engineering; Monomer; Copolymer; Chemistry; Polymer chemistry; Molecule; Organic chemistry; Aqueous solution","retraction":null,"screen_n_in":null,"score":{"opus":0.02210219467987499,"gpt":0.322326319243349,"spread":0.300224124563474,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0001204632,0.0002762986,0.0006402369,0.00006283759,0.0002937835,0.0001472176,0.0007374684,0.0001941561,0.0001691612],"category_scores_gemma":[0.0002471167,0.0002584708,0.0002564231,0.0007294323,0.0001149418,0.00020718,0.0002176293,0.0001565872,0.00001125686],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002494112,"about_ca_system_score_gemma":0.0004639598,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":4.82289e-7,"about_ca_topic_score_gemma":1.294531e-7,"domain_scores_codex":[0.9980973,0.000008610934,0.0004565737,0.0007427492,0.0003006595,0.0003941093],"domain_scores_gemma":[0.9984919,0.000367294,0.0003478735,0.0004720045,0.0001614802,0.0001593853],"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":[2.141697e-7,0.00007819316,0.000001662067,0.00635966,0.00002489636,4.44523e-7,0.00005840829,0.000001003153,0.09217412,0.001000327,0.00003198421,0.9002691],"study_design_scores_gemma":[0.00002316384,0.000001159359,6.834097e-8,0.003908658,0.0001630377,0.000007096639,0.00001928237,0.0002092487,0.0208671,0.00001600919,0.9744565,0.0003286653],"study_design_candidate":"not_applicable","study_design_consensus":null,"genre_codex":"review","genre_gemma":"review","genre_scores_codex":[0.00001683602,0.9614318,0.0361539,0.00001354254,0.00007485169,0.0003093758,0.00005986723,0.00016847,0.001771337],"genre_scores_gemma":[0.000122962,0.9914478,0.006363147,0.00001913797,0.0004655716,0.0009861717,0.0002608062,0.00005456015,0.0002798229],"genre_candidate":"review","genre_consensus":"review","teacher_disagreement_score":0.9744245,"threshold_uncertainty_score":0.9999868,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3005449605","doi":"10.1039/d0sc00136h","title":"Electrochemical biomass valorization on gold-metal oxide nanoscale heterojunctions enables investigation of both catalyst and reaction dynamics with <i>operando</i> surface-enhanced Raman spectroscopy","year":2020,"lang":"en","type":"article","venue":"Chemical Science","topic":"Electrocatalysts for Energy Conversion","field":"Energy","cited_by":224,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Université de Montréal","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Catalysis; Electrochemistry; Faraday efficiency; Redox; Oxidizing agent; Raman spectroscopy; Chemical engineering; Nanomaterials; Context (archaeology); Oxide; Chemistry; Materials science; Nanotechnology; Inorganic chemistry; Electrode; Organic chemistry; Physical chemistry","retraction":null,"screen_n_in":null,"score":{"opus":0.006635371341638012,"gpt":0.1988348990264857,"spread":0.1921995276848476,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001882542,0.0002383941,0.0002799323,0.00009246881,0.0001552156,0.00005090717,0.0002872808,0.0001188403,0.000004703971],"category_scores_gemma":[0.0001848732,0.0002038074,0.0000528108,0.001541377,0.0007233237,0.000521528,0.00007396836,0.0002152187,0.000007445752],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004208898,"about_ca_system_score_gemma":0.0001534551,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003633206,"about_ca_topic_score_gemma":0.0001016658,"domain_scores_codex":[0.997894,0.0000312399,0.0003014978,0.0006953235,0.0006659008,0.0004120433],"domain_scores_gemma":[0.9990323,0.00006668701,0.0001766636,0.0002589691,0.0001779482,0.0002874705],"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":[0.0002449039,0.00003428213,0.0003792381,0.00003036597,0.00001611354,7.837026e-7,0.0001140961,0.00007225396,0.9978932,0.001105278,0.00002231863,0.00008717225],"study_design_scores_gemma":[0.0007100907,0.0002892328,0.0002295153,0.00003681833,0.00004337719,0.000009305496,0.00004416895,0.004298299,0.9938796,0.0001793881,0.00004772219,0.0002324582],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9950571,0.0000218591,0.003054373,0.0004584424,0.00005262141,0.0001485696,0.00000239947,0.0001255721,0.001079077],"genre_scores_gemma":[0.9979326,0.00002091561,0.001614127,0.0001543611,0.00005056721,0.000009620217,0.0001524634,0.00002543843,0.00003987985],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004226045,"threshold_uncertainty_score":0.8311024,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2120072163","doi":"10.1039/c2sc20344h","title":"Accelerated aging: a low energy, solvent-free alternative to solvothermal and mechanochemical synthesis of metal–organic materials","year":2012,"lang":"en","type":"article","venue":"Chemical Science","topic":"Metal-Organic Frameworks: Synthesis and Applications","field":"Chemistry","cited_by":217,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"McGill University; Bruker (Canada); Centre in Green Chemistry and Catalysis","funders":"","keywords":"Materials science; Mechanochemistry; Solvothermal synthesis; Solvent; Metal; Chemical engineering; Nanotechnology; Organic chemistry; Chemistry; Inorganic chemistry; Metallurgy","retraction":null,"screen_n_in":null,"score":{"opus":0.02025074209256891,"gpt":0.2554762917725865,"spread":0.2352255496800175,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0004545606,0.000226057,0.0003756532,0.00006267925,0.0001108719,0.00007525027,0.00108673,0.0001443365,0.002694545],"category_scores_gemma":[0.001189125,0.000193183,0.00005965851,0.000518334,0.0004691671,0.0002396971,0.000649209,0.0001213124,0.00002248924],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00008364464,"about_ca_system_score_gemma":0.00006228884,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00003429386,"about_ca_topic_score_gemma":5.522358e-7,"domain_scores_codex":[0.9980553,0.00001667432,0.000388867,0.0004986965,0.0004586268,0.0005817939],"domain_scores_gemma":[0.9983786,0.0002430927,0.0001699805,0.0006640362,0.0001071408,0.0004371706],"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":[0.00001027703,0.0001403633,0.0000324413,0.00003440526,0.00002192039,3.415713e-7,0.0001204509,2.902248e-7,0.9954034,0.00261234,0.0001015245,0.001522207],"study_design_scores_gemma":[0.0001075419,0.000004074484,0.00002602948,0.0000913469,0.00004137676,0.000007216854,0.00006294055,0.00008580941,0.9984171,0.0007031391,0.0002255178,0.0002279074],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9966807,0.0001297257,0.00108786,0.0004230182,0.00006702049,0.00006884155,0.00004601144,0.00005302181,0.00144382],"genre_scores_gemma":[0.9964939,0.00002456924,0.00295369,0.0001275457,0.0002021938,0.00007751723,0.000004015727,0.00002627809,0.00009028999],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003013661,"threshold_uncertainty_score":0.9982171,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2605521873","doi":"10.1039/c7sc00641a","title":"1D vs. 2D shape selectivity in the crystallization-driven self-assembly of polylactide block copolymers","year":2017,"lang":"en","type":"article","venue":"Chemical Science","topic":"Advanced Polymer Synthesis and Characterization","field":"Chemistry","cited_by":215,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Kensington Health","funders":"Engineering and Physical Sciences Research Council; University of Warwick; Royal Society","keywords":"Copolymer; Crystallization; Selectivity; Materials science; Block (permutation group theory); Self-assembly; Polymer science; Polymer chemistry; Nanotechnology; Chemical engineering; Polymer; Composite material; Chemistry; Organic chemistry; Mathematics; Engineering; Geometry; Catalysis","retraction":null,"screen_n_in":null,"score":{"opus":0.01072634059616268,"gpt":0.2595211287564793,"spread":0.2487947881603166,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001873116,0.0001232412,0.0001624177,0.00003211021,0.0003170943,0.0001064935,0.001097118,0.00007207382,0.00008123725],"category_scores_gemma":[0.0003309311,0.00009548657,0.00004486455,0.0002385235,0.0004450298,0.0004474544,0.0001342137,0.0001386325,0.000003368296],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00008215688,"about_ca_system_score_gemma":0.0001267438,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00004629075,"about_ca_topic_score_gemma":0.000007084917,"domain_scores_codex":[0.9987369,0.00001153655,0.000210645,0.0003303663,0.0004122682,0.0002983453],"domain_scores_gemma":[0.9989399,0.0001126083,0.000269133,0.0005380766,0.00006492354,0.00007535768],"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":[0.00001242061,0.00009365212,0.01062522,0.00002143654,0.000003034222,0.000001155608,0.0003270278,0.000003496855,0.987111,0.0001565441,0.00001047131,0.001634503],"study_design_scores_gemma":[0.0001463091,0.000006172383,0.008402482,0.00003353155,0.00000854489,0.000004665008,0.00007654984,0.002729362,0.9882336,0.0000421797,0.0001954104,0.0001211918],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9926412,0.00002512754,0.00009937131,0.0003207487,0.00004015579,0.00005027258,0.0000069894,0.00002805591,0.006788133],"genre_scores_gemma":[0.9996024,0.00001871748,0.0001829788,0.0000715085,0.00006259215,0.00001151297,0.000003492233,0.000008667838,0.0000381009],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.006961283,"threshold_uncertainty_score":0.3893829,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2056465421","doi":"10.1039/c2sc20542d","title":"Catalytic enantioselective carbon-carbon bond formation using cycloisomerization reactions","year":2012,"lang":"en","type":"article","venue":"Chemical Science","topic":"Catalytic Alkyne Reactions","field":"Chemistry","cited_by":213,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Ontario Institute for Cancer Research","funders":"","keywords":"Cycloisomerization; Enantioselective synthesis; Intramolecular force; Hydroacylation; Chemistry; Enyne; Catalysis; Combinatorial chemistry; Olefin fiber; Organic chemistry; Stereochemistry; Rhodium","retraction":null,"screen_n_in":null,"score":{"opus":0.01966666854158626,"gpt":0.2670657301853839,"spread":0.2473990616437976,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002222205,0.0001497412,0.000136223,0.0001133867,0.0002574142,0.00005530231,0.0002337054,0.00009831979,0.00002341098],"category_scores_gemma":[0.0005312716,0.0001488248,0.0000512306,0.001078657,0.0003819973,0.000917191,0.00009874808,0.0002196648,0.00001491434],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001095583,"about_ca_system_score_gemma":0.0001675732,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004057677,"about_ca_topic_score_gemma":0.000003110795,"domain_scores_codex":[0.9984298,0.000003833127,0.0002694869,0.0002927121,0.0004488565,0.0005553132],"domain_scores_gemma":[0.9990456,0.00007083418,0.0001623814,0.0003316079,0.0001409939,0.0002485649],"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":[0.000003282937,0.00006757145,0.001048813,0.00002254281,0.000004776218,2.526554e-7,0.0003762475,0.00001050168,0.9976718,0.0001787454,0.000005125392,0.0006103456],"study_design_scores_gemma":[0.0001228115,0.000002260367,0.000269381,0.00003205656,0.00003809535,0.0001021757,0.0002132955,0.01647319,0.9820315,0.0001483856,0.0003748928,0.000191921],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9510324,0.0000491901,0.000375756,0.00005132013,0.0001696929,0.00007262058,0.000004666028,0.0001145078,0.04812986],"genre_scores_gemma":[0.9991177,0.000006680018,0.0004169575,0.00001217849,0.0002636336,0.00001538223,0.00002739403,0.00001591992,0.0001240951],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.04808537,"threshold_uncertainty_score":0.6068898,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2339898404","doi":"10.1039/c6sc00807k","title":"Direct alkylation of heteroarenes with unactivated bromoalkanes using photoredox gold catalysis","year":2016,"lang":"en","type":"article","venue":"Chemical Science","topic":"Catalytic C–H Functionalization Methods","field":"Chemistry","cited_by":207,"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; American Chemical Society Petroleum Research Fund; University of Ottawa","keywords":"Alkylation; Catalysis; Photoredox catalysis; Chemistry; Combinatorial chemistry; Organic chemistry; Photochemistry; Photocatalysis","retraction":null,"screen_n_in":null,"score":{"opus":0.02408993069427501,"gpt":0.2796214323731305,"spread":0.2555315016788555,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002191575,0.0001218621,0.0001774274,0.00007399152,0.00005844724,0.00002367501,0.0002759583,0.00005961998,0.0004768099],"category_scores_gemma":[0.0005582827,0.00007821467,0.00004676645,0.0008408673,0.0007522475,0.0002999107,0.00008313993,0.00003950983,0.000003849321],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002245345,"about_ca_system_score_gemma":0.0001339107,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001149329,"about_ca_topic_score_gemma":0.000002079538,"domain_scores_codex":[0.9986289,0.000008068755,0.0002249887,0.0003988935,0.0005250158,0.0002141761],"domain_scores_gemma":[0.998934,0.0002106942,0.0001679809,0.0003440822,0.0002337719,0.0001094797],"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":[0.00003175532,0.0000337302,0.00333944,0.00002630124,0.00001083205,6.484991e-7,0.00003318733,0.00004003739,0.9946839,0.00002966834,0.00001362165,0.001756849],"study_design_scores_gemma":[0.0002457663,0.000006208355,0.0002843018,0.0001273666,0.00002312637,0.00001345122,0.00001688703,0.0008445134,0.9980605,0.00005798089,0.0001851689,0.0001347074],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9925386,0.00001786566,0.004017429,0.00003580124,0.00003452682,0.00003410192,0.00001493041,0.00005658626,0.003250113],"genre_scores_gemma":[0.9963295,0.000002263076,0.003158359,0.00001035378,0.00004888907,0.00000525218,0.00001374439,0.00001114869,0.0004204264],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003790919,"threshold_uncertainty_score":0.5220734,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2801950439","doi":"10.1039/c8sc01170b","title":"Deciphering the working mechanism of aggregation-induced emission of tetraphenylethylene derivatives by ultrafast spectroscopy","year":2018,"lang":"en","type":"article","venue":"Chemical Science","topic":"Luminescence and Fluorescent Materials","field":"Materials Science","cited_by":201,"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":"Division of Chemistry; Fundamental Research Funds for the Central Universities; National Key Research and Development Program of China; Hong Kong University of Science and Technology; University of Hong Kong; China Postdoctoral Science Foundation; Innovation and Technology Commission; National Natural Science Foundation of China; National Science Foundation","keywords":"Tetraphenylethylene; Aggregation-induced emission; Mechanism (biology); Spectroscopy; Chemistry; Ultrashort pulse; Photochemistry; Chemical physics; Physics; Optics; Laser","retraction":null,"screen_n_in":null,"score":{"opus":0.01713474290257045,"gpt":0.2638723317458445,"spread":0.246737588843274,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0007666624,0.0001255581,0.0002008453,0.00003733293,0.0001977502,0.00006021957,0.0008826746,0.00005471195,0.0002179669],"category_scores_gemma":[0.0004463096,0.00008039825,0.00003756872,0.0005346065,0.001471834,0.0002433394,0.0001643085,0.0000590507,0.00001115717],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00003911529,"about_ca_system_score_gemma":0.00008251429,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00003165758,"about_ca_topic_score_gemma":8.442316e-7,"domain_scores_codex":[0.9983665,0.00003042756,0.0003575984,0.0003447904,0.0005539736,0.0003467085],"domain_scores_gemma":[0.9990686,0.0001012655,0.0002516609,0.000324831,0.0001631906,0.00009047694],"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":[0.00001955675,0.00003490537,0.0002980371,0.0000130213,0.000001159943,1.567775e-7,0.0006406953,1.072746e-7,0.9981998,0.0004061775,0.00003442352,0.0003520133],"study_design_scores_gemma":[0.0001155262,0.00005496158,0.0001850085,0.0001567305,0.000004677009,0.000001784114,0.0001523588,0.00005273872,0.9983385,0.0008174586,0.00002097749,0.00009929304],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9975519,0.00002356556,0.001355322,0.00009983342,0.0003283953,0.0001311881,0.000004174266,0.00002680832,0.0004787782],"genre_scores_gemma":[0.9969095,0.000009597329,0.002896938,0.00003959721,0.0001203298,0.000005243868,9.18154e-7,0.000007303792,0.00001055876],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001541616,"threshold_uncertainty_score":0.5423033,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3095699706","doi":"10.1039/d0sc04611f","title":"A critical analysis of electrospray techniques for the determination of accelerated rates and mechanisms of chemical reactions in droplets","year":2020,"lang":"en","type":"article","venue":"Chemical Science","topic":"Electrohydrodynamics and Fluid Dynamics","field":"Engineering","cited_by":194,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"","funders":"Basic Energy Sciences; Natural Sciences and Engineering Research Council of Canada; U.S. Department of Energy; National Science Foundation","keywords":"Electrospray; Chemistry; Biochemical engineering; Nanotechnology; Chromatography; Mass spectrometry; Materials science; Engineering","retraction":null,"screen_n_in":null,"score":{"opus":0.01093085480101701,"gpt":0.2696952290480651,"spread":0.2587643742470481,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001845825,0.00005994625,0.0001806686,0.0000944174,0.00001478266,0.00000920926,0.0001708373,0.00004891579,0.000002229323],"category_scores_gemma":[0.0004075568,0.00004835326,0.00004232494,0.001444059,0.0002542463,0.00007886848,0.00002873784,0.00008119969,2.026389e-8],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00003257041,"about_ca_system_score_gemma":0.00002141186,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000008736833,"about_ca_topic_score_gemma":0.000002754435,"domain_scores_codex":[0.9993651,0.000003896252,0.0002350387,0.0001319658,0.0001253135,0.0001386985],"domain_scores_gemma":[0.9995053,0.000223278,0.00003393344,0.00008251477,0.0001150122,0.00003989787],"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":[0.000006734803,0.00001414212,0.00005227386,0.00003801713,0.000009836483,7.773776e-8,0.00004621629,0.00007358015,0.9911014,0.007947585,7.717167e-7,0.0007094091],"study_design_scores_gemma":[0.00002582783,0.00001665176,0.00007289917,0.00000456654,0.00003016459,2.932672e-7,0.000004427446,0.4833646,0.5154895,0.0009650222,5.192753e-7,0.00002544956],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.7598396,0.00002981691,0.2397877,0.000164083,0.000006720982,0.0001058281,0.00001163869,0.00001934518,0.00003531739],"genre_scores_gemma":[0.9925454,0.00001984006,0.007395091,0.00001234727,0.000003965814,0.00001417284,0.000004241456,0.00000468417,2.758879e-7],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.4832911,"threshold_uncertainty_score":0.1971789,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2925305072","doi":"10.1039/c9sc00783k","title":"Nickel-catalyzed C–N bond activation: activated primary amines as alkylating reagents in reductive cross-coupling","year":2019,"lang":"en","type":"article","venue":"Chemical Science","topic":"Catalytic C–H Functionalization Methods","field":"Chemistry","cited_by":193,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Kootenay Association for Science & Technology","funders":"China Scholarship Council; King Abdullah University of Science and Technology","keywords":"Catalysis; Reagent; Aryl; Nickel; Catalytic cycle; Chemistry; Combinatorial chemistry; Density functional theory; Halide; Stoichiometry; Coupling reaction; Primary (astronomy); Functional group; Computational chemistry; Coupling (piping); Organic chemistry; Materials science","retraction":null,"screen_n_in":null,"score":{"opus":0.02325778623421556,"gpt":0.3231063022990839,"spread":0.2998485160648684,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.000575167,0.0002052052,0.0002516956,0.00012311,0.000140649,0.0001372548,0.0005376333,0.0001511101,0.001040266],"category_scores_gemma":[0.002449154,0.0002076901,0.00006120276,0.001531385,0.0005278756,0.0008902831,0.000321439,0.0003184245,0.0001142155],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0007685032,"about_ca_system_score_gemma":0.000300939,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00006704516,"about_ca_topic_score_gemma":4.216689e-7,"domain_scores_codex":[0.9975055,0.000005913226,0.0004385513,0.0008401737,0.0007693619,0.0004405317],"domain_scores_gemma":[0.9984722,0.0003786464,0.0002307523,0.0005040567,0.0002612835,0.0001530832],"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":[0.00006835581,0.00006431367,0.01042808,0.00005476171,0.000006458462,0.000001458772,0.0001607236,0.0002564064,0.9880177,0.0001400672,0.00003578079,0.0007658738],"study_design_scores_gemma":[0.0006228021,0.000003956085,0.004536744,0.0001133288,0.000004823482,0.00001298127,0.0001495756,0.001724915,0.9919011,0.0004530987,0.0002271854,0.0002495069],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9785961,0.0000163193,0.0001345283,0.0001058777,0.0001853468,0.0001323105,0.00000479318,0.0000936658,0.02073109],"genre_scores_gemma":[0.9951359,0.000002280786,0.002305505,0.00008889775,0.0001527448,0.0000213358,0.0001089395,0.00002313126,0.002161282],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01856981,"threshold_uncertainty_score":0.9998729,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2196777184","doi":"10.1039/c5sc03115j","title":"A poised fragment library enables rapid synthetic expansion yielding the first reported inhibitors of PHIP(2), an atypical bromodomain","year":2015,"lang":"en","type":"article","venue":"Chemical Science","topic":"Protein Degradation and Inhibitors","field":"Biochemistry, Genetics and Molecular Biology","cited_by":191,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Structural Genomics Consortium","funders":"Janssen Pharmaceuticals; Engineering and Physical Sciences Research Council; Ministero dello Sviluppo Economico; Swansea University; Worldwide Cancer Research; Ontario Ministry of Economic Development and Innovation; Wellcome Trust; Takeda Pharmaceutical Company; European Federation of Pharmaceutical Industries and Associations; AbbVie; Wellcome; Merck; Fundação de Amparo à Pesquisa do Estado de São Paulo; Genome Canada; Novartis Pharma; Novartis; European Commission; Pfizer","keywords":"Bromodomain; Fragment (logic); Chemistry; Combinatorial chemistry; Stereochemistry; Computational biology; Biochemistry; Computer science; Biology; Epigenetics; Algorithm","retraction":null,"screen_n_in":null,"score":{"opus":0.02217427758218534,"gpt":0.2444993015377055,"spread":0.2223250239555202,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0004983828,0.0001124169,0.0001106944,0.00003615871,0.000114208,0.00004317308,0.0004541571,0.0001021808,0.00002846766],"category_scores_gemma":[0.0005996432,0.00007602231,0.00005630369,0.0003113252,0.0006469264,0.00003335229,0.0002689857,0.00008912392,0.000002782693],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00002125677,"about_ca_system_score_gemma":0.0001994755,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000007630457,"about_ca_topic_score_gemma":8.943229e-7,"domain_scores_codex":[0.9987018,0.00003519468,0.0002714384,0.0003903894,0.0003665939,0.0002346408],"domain_scores_gemma":[0.999122,0.00001983389,0.0001178786,0.0004587948,0.00006799289,0.0002135296],"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":[0.00006766271,0.00007197922,0.0003395309,0.000005989814,0.000003356996,0.00000164199,0.00009941862,0.000006825389,0.9959192,0.00008217463,0.001919505,0.001482748],"study_design_scores_gemma":[0.0002346075,0.0001272677,0.0001968509,0.00003610931,0.000005025271,0.00001424641,0.0001660602,0.0002219679,0.9913345,0.0002412131,0.007309909,0.0001122336],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9975514,0.0002271338,0.0002020712,0.0008843635,0.0001336201,0.0001725239,0.000002388862,0.00002185424,0.0008046224],"genre_scores_gemma":[0.9987321,0.00001946467,0.0007451237,0.0002595532,0.0001540172,0.00001592349,0.0000178648,0.000009567172,0.00004637328],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.005390404,"threshold_uncertainty_score":0.31001,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3015692433","doi":"10.1039/d0sc00445f","title":"Machine learning dihydrogen activation in the chemical space surrounding Vaska's complex","year":2020,"lang":"en","type":"article","venue":"Chemical Science","topic":"Machine Learning in Materials Science","field":"Materials Science","cited_by":189,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Vector Institute; Canadian Institute for Advanced Research; Toronto Metropolitan University; University of Toronto; Toronto Public Health","funders":"Natural Resources Canada; Horizon 2020 Framework Programme; Norges Forskningsråd; European Commission; Compute Canada","keywords":"Chemical space; Space (punctuation); Computer science; Chemistry; Materials science; Biochemistry; Drug discovery; Operating system","retraction":null,"screen_n_in":null,"score":{"opus":0.03534743907417005,"gpt":0.2820316854995478,"spread":0.2466842464253778,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.002583301,0.000219849,0.0002592086,0.0000659178,0.0003764519,0.00048609,0.002132258,0.00007009695,0.0005733876],"category_scores_gemma":[0.003376649,0.00015796,0.0000501072,0.001637721,0.001073826,0.0006246619,0.0005196428,0.0004761098,0.0002416001],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001578533,"about_ca_system_score_gemma":0.0001074188,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001455049,"about_ca_topic_score_gemma":0.000001528745,"domain_scores_codex":[0.9966935,0.0002004366,0.0003665377,0.0008318038,0.00118281,0.0007249295],"domain_scores_gemma":[0.9988257,0.0003682608,0.0001807805,0.0003222411,0.0000666061,0.000236385],"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":[0.00001958846,0.00002679844,0.001744965,0.00001657631,4.1659e-7,0.000003432315,0.001551663,0.0006219172,0.9949415,0.0008497133,0.00006181734,0.0001616459],"study_design_scores_gemma":[0.0002199914,0.00003253853,0.0008860869,0.00002190165,0.000002711877,0.000011836,0.00018381,0.05275233,0.944079,0.0003095722,0.001268029,0.00023222],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9898614,0.0000134813,0.001586012,0.005954979,0.0001260384,0.0002094486,0.000002600414,0.0001524206,0.002093621],"genre_scores_gemma":[0.9945978,0.000001979715,0.004011407,0.001137021,0.0001999751,0.00001685251,0.000008346895,0.00001377179,0.00001285406],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.05213041,"threshold_uncertainty_score":0.644142,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2004362149","doi":"10.1039/c3sc53416b","title":"The Houk–List transition states for organocatalytic mechanisms revisited","year":2014,"lang":"en","type":"article","venue":"Chemical Science","topic":"Molecular spectroscopy and chirality","field":"Chemistry","cited_by":186,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Kensington Health","funders":"Engineering and Physical Sciences Research Council; Agence Nationale de la Recherche","keywords":"Stereoselectivity; Variety (cybernetics); Aldol reaction; Intermolecular force; Chemistry; Computer science; Catalysis; Organic chemistry; Molecule; Artificial intelligence","retraction":null,"screen_n_in":null,"score":{"opus":0.005091128774179839,"gpt":0.2412360014187901,"spread":0.2361448726446102,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0004415918,0.00009093346,0.00009077653,0.000008568335,0.000351532,0.0001183597,0.0004816649,0.00004481362,0.00007908623],"category_scores_gemma":[0.0002934742,0.00006244414,0.00005560804,0.0002025999,0.0003970838,0.00007438412,0.00003953611,0.00009352419,0.000009180967],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00006268584,"about_ca_system_score_gemma":0.00003386511,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000006375657,"about_ca_topic_score_gemma":0.000001112263,"domain_scores_codex":[0.9989717,0.00000587412,0.0001408563,0.0003047358,0.0002598062,0.0003170125],"domain_scores_gemma":[0.9993563,0.00009616247,0.00004614327,0.0003272909,0.00006686771,0.0001071798],"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":[0.00001283647,0.00001273507,0.000002210712,0.0000287631,0.000001862184,1.651503e-7,0.0000499754,9.789786e-7,0.9856643,0.01328894,0.0001153911,0.0008218361],"study_design_scores_gemma":[0.0001471435,0.00001110601,0.000004517593,0.0000161273,0.00000988236,0.000002471197,0.00002318944,0.004007601,0.9627583,0.03002286,0.00290268,0.00009412599],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.840721,0.00008972051,0.1467473,0.002585992,0.0001027908,0.00018266,0.00003146003,0.000166843,0.009372284],"genre_scores_gemma":[0.998199,0.000007158672,0.001253342,0.0003051268,0.00006546009,0.00001697152,0.00002769251,0.000007591508,0.0001176842],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.157478,"threshold_uncertainty_score":0.2703736,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2901583234","doi":"10.1039/c8sc04155e","title":"Synthesis of uniform ordered mesoporous TiO<sub>2</sub> microspheres with controllable phase junctions for efficient solar water splitting","year":2018,"lang":"en","type":"article","venue":"Chemical Science","topic":"Advanced Photocatalysis Techniques","field":"Energy","cited_by":179,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"","funders":"Institute of Population and Public Health; Science and Technology Commission of Shanghai Municipality; King Saud University; National Natural Science Foundation of China","keywords":"Mesoporous material; Anatase; Rutile; Photocatalysis; Materials science; Chemical engineering; Nanotechnology; Phase (matter); Specific surface area; Porosity; Microsphere; Catalysis; Composite material; Chemistry; Organic chemistry","retraction":null,"screen_n_in":null,"score":{"opus":0.008013176443784497,"gpt":0.256864820216162,"spread":0.2488516437723775,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0004571559,0.0001782457,0.0002953077,0.00006421347,0.0003143252,0.00004433022,0.0004413165,0.00007250865,0.00004210173],"category_scores_gemma":[0.0004096097,0.0001186294,0.00007463398,0.0005719828,0.001263686,0.0001731756,0.0001135831,0.00008084668,0.00001801003],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001761648,"about_ca_system_score_gemma":0.00007795038,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00008476163,"about_ca_topic_score_gemma":0.0000425648,"domain_scores_codex":[0.9982899,0.00001033188,0.0003301401,0.0004917963,0.0003207799,0.0005570271],"domain_scores_gemma":[0.9986686,0.000145652,0.0001364415,0.0004472251,0.0004718166,0.0001303329],"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":[0.0002254717,0.0001662496,0.00001003293,0.00001909231,0.00001550246,6.442741e-7,0.0001142079,0.0001634336,0.9925181,0.000318563,0.00006718234,0.00638151],"study_design_scores_gemma":[0.0006737947,0.0001392499,0.000002873299,0.00004242468,0.00004785964,0.000005873428,0.00007209749,0.004236049,0.9926369,0.0008344344,0.001121233,0.00018717],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9800488,0.00001563577,0.01793714,0.00005405376,0.00004659778,0.0003990497,0.00001268975,0.000145028,0.001340959],"genre_scores_gemma":[0.9819843,0.000001747766,0.0176589,0.00004838761,0.00005695454,0.0001645961,0.000008471978,0.00002264294,0.00005406579],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.00619434,"threshold_uncertainty_score":0.4837565,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4205996046","doi":"10.1039/d1sc05512g","title":"Revisiting the adhesion mechanism of mussel-inspired chemistry","year":2022,"lang":"en","type":"article","venue":"Chemical Science","topic":"Polymer Surface Interaction Studies","field":"Materials Science","cited_by":179,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Alberta","funders":"Canadian Network for Research and Innovation in Machining Technology, Natural Sciences and Engineering Research Council of Canada; Natural Sciences and Engineering Research Council of Canada; National Natural Science Foundation of China; Canada Research Chairs; Canada Foundation for Innovation","keywords":"Mussel; Mechanism (biology); Adhesion; Catechol; Chemistry; Nanotechnology; Polymer science; Biochemistry; Materials science; Biology; Philosophy; Ecology; Epistemology; Organic chemistry","retraction":null,"screen_n_in":null,"score":{"opus":0.01864877239615262,"gpt":0.2681952177638973,"spread":0.2495464453677446,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.000968067,0.00008125739,0.0001265187,0.00001713887,0.0005729331,0.00003682117,0.000882252,0.00001407301,0.001148343],"category_scores_gemma":[0.000516196,0.00005802961,0.00004598876,0.0005032501,0.0005265764,0.000147054,0.0009557668,0.0001406597,0.00002668217],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001158876,"about_ca_system_score_gemma":0.00008224073,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00003097164,"about_ca_topic_score_gemma":7.207245e-8,"domain_scores_codex":[0.9984559,0.00002984226,0.0002263794,0.0003121436,0.0007084214,0.0002672639],"domain_scores_gemma":[0.9992062,0.0001961985,0.0001636518,0.000303718,0.00007305086,0.00005711762],"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":[0.000006523608,0.00001006384,0.00003194219,0.000008216722,8.624335e-7,9.499836e-7,0.0002341011,0.000006058883,0.9987992,0.0002434278,0.00007943725,0.0005791922],"study_design_scores_gemma":[0.0000563311,0.00000620111,0.00004758284,0.00001169753,0.000004240716,0.00001402758,0.0006377654,0.0002583205,0.9976349,0.0002737548,0.0009823218,0.00007279453],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9950405,0.0001388054,0.00006059078,0.0009488665,0.0002873743,0.00006019984,0.000009086334,0.00004791857,0.003406656],"genre_scores_gemma":[0.9993196,0.000003135293,0.0002818011,0.000164939,0.00006384719,0.00002371612,4.795313e-7,0.000004600976,0.0001378398],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004279139,"threshold_uncertainty_score":0.9997647,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2588503875","doi":"10.1039/c6sc04819f","title":"Mo<sup>6+</sup>activated multimetal oxygen-evolving catalysts","year":2017,"lang":"en","type":"article","venue":"Chemical Science","topic":"Electrocatalysts for Energy Conversion","field":"Energy","cited_by":176,"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":"Beijing Synchrotron Radiation Facility; Specialized Research Fund for the Doctoral Program of Higher Education of China; Fundamental Research Funds for the Central Universities; Higher Education Discipline Innovation Project; National Natural Science Foundation of China; Program of Shanghai Subject Chief Scientist; Natural Science Foundation of Shanghai","keywords":"Catalysis; Oxygen; Chemistry; Organic chemistry","retraction":null,"screen_n_in":null,"score":{"opus":0.01240394244293214,"gpt":0.2471104323599925,"spread":0.2347064899170603,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0005032571,0.0002487552,0.0002532618,0.0001230152,0.001029056,0.0003003396,0.002239986,0.0001431535,0.0001402852],"category_scores_gemma":[0.001860844,0.0002204897,0.0001187667,0.0004563259,0.001175487,0.00136469,0.0007022701,0.0002846595,0.0004287128],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004787369,"about_ca_system_score_gemma":0.0001712275,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.002060664,"about_ca_topic_score_gemma":0.00001990187,"domain_scores_codex":[0.9971761,0.00001615623,0.0002476237,0.0008210464,0.0009018326,0.0008372597],"domain_scores_gemma":[0.9980026,0.00006430218,0.0001816156,0.001103092,0.0002673936,0.0003809603],"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":[0.00001452108,0.00004152299,0.0002470669,0.000006348937,0.00001365538,0.00001008689,0.0001163897,0.0001605652,0.9917953,0.0009096516,0.0003035565,0.006381327],"study_design_scores_gemma":[0.0003770605,0.00001694801,0.000867796,0.0000246333,0.00001681576,0.00001882166,0.00002638915,0.02207023,0.9739806,0.0003460043,0.001952561,0.0003021536],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.968006,0.0000434677,0.00003559146,0.0002224074,0.0001170938,0.00007453908,9.727349e-7,0.0001804622,0.03131947],"genre_scores_gemma":[0.9980081,0.000004337085,0.0008651852,0.00008099344,0.0001468627,0.0000101987,0.00001535291,0.00002559248,0.0008433501],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.03047612,"threshold_uncertainty_score":0.8991307,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W1914744055","doi":"10.1039/c5sc02207j","title":"Boron chemistry in a new light","year":2015,"lang":"en","type":"review","venue":"Chemical Science","topic":"Radical Photochemical Reactions","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":"Canadian Nautical Research Society","funders":"Centre National de la Recherche Scientifique; Université de Strasbourg","keywords":"Boron; Radical; Photochemistry; Chemistry; Energy transfer; Visible spectrum; Carbon fibers; Electron transfer; Chemical physics; Materials science; Organic chemistry; Optoelectronics","retraction":null,"screen_n_in":null,"score":{"opus":0.05094390556664295,"gpt":0.359347674390542,"spread":0.308403768823899,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow","insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0003875305,0.0005665154,0.001410791,0.00008631056,0.00005656284,0.0001199872,0.002351574,0.0008110005,0.001606175],"category_scores_gemma":[0.002214676,0.0004726635,0.0003587753,0.001800491,0.0007401105,0.0002069898,0.0005450679,0.00158999,0.0003541654],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.002259317,"about_ca_system_score_gemma":0.004620938,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00007083203,"about_ca_topic_score_gemma":0.000001420127,"domain_scores_codex":[0.9958103,0.000008758842,0.0008163499,0.001301258,0.001099371,0.0009639313],"domain_scores_gemma":[0.9969628,0.0001900414,0.0002761852,0.001039359,0.00008120488,0.001450432],"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":[0.000004646982,0.0001558617,9.640396e-7,0.004953474,0.00001282103,0.00003435974,0.00003085805,8.416761e-8,0.2046747,0.00003718944,0.009158929,0.7809361],"study_design_scores_gemma":[0.0001614462,0.000001862583,2.950084e-8,0.004242851,0.00006809217,0.00006540168,0.000005546959,0.000008263965,0.06913806,0.0003887928,0.9254181,0.0005016086],"study_design_candidate":"not_applicable","study_design_consensus":null,"genre_codex":"review","genre_gemma":"review","genre_scores_codex":[0.0001110618,0.8604572,0.00000168358,0.00006741052,0.00007811122,0.000165987,0.00001658505,0.0001332533,0.1389687],"genre_scores_gemma":[0.00008025523,0.9936396,0.0002970577,0.00003157663,0.0007037039,0.0001099931,0.00007330243,0.0000728402,0.004991686],"genre_candidate":"review","genre_consensus":"review","teacher_disagreement_score":0.9162591,"threshold_uncertainty_score":0.9997725,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W1976609113","doi":"10.1039/c2sc21161k","title":"Reactions of phosphorus/boron frustrated Lewis pairs with SO<sub>2</sub>","year":2012,"lang":"en","type":"article","venue":"Chemical Science","topic":"Organoboron and organosilicon chemistry","field":"Chemistry","cited_by":172,"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; Canada Research Chairs","keywords":"Frustrated Lewis pair; Adduct; Intramolecular force; Boron; Lewis acids and bases; Chemistry; Yield (engineering); Vicinal; Sulfur; Phosphorus; Crystallography; Stereochemistry; Medicinal chemistry; Catalysis; Organic chemistry; Materials science","retraction":null,"screen_n_in":null,"score":{"opus":0.01003557641784561,"gpt":0.2222899453440468,"spread":0.2122543689262012,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002031823,0.0002110162,0.0002130785,0.00003005174,0.0001619131,0.00004573471,0.0004938498,0.0001721985,0.0006213976],"category_scores_gemma":[0.0001939069,0.0001778383,0.0000595883,0.0006997611,0.001394741,0.0003715507,0.0001157146,0.0003112828,0.00005113912],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001866755,"about_ca_system_score_gemma":0.0002789524,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00004027919,"about_ca_topic_score_gemma":0.000001514264,"domain_scores_codex":[0.9981047,0.000004355923,0.0002869054,0.0004076569,0.0005352946,0.0006610994],"domain_scores_gemma":[0.9986994,0.00006198986,0.0001499643,0.0004836076,0.0001327523,0.0004723368],"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":[0.00001743452,0.0002586842,0.008915513,0.00005175688,0.000008601736,0.000001335721,0.0001322897,5.905372e-7,0.9883991,0.00008179557,0.0002651009,0.001867806],"study_design_scores_gemma":[0.0003207953,0.00001003729,0.0009667618,0.000051657,0.00002204734,0.00003069071,0.0002189838,0.00001843291,0.9966329,0.0000179097,0.001462114,0.0002476946],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9901341,0.0002043191,0.00001225188,0.0001195408,0.00006496251,0.00003893011,0.00001512293,0.0001267208,0.009284079],"genre_scores_gemma":[0.9994091,0.00004537574,0.0002239691,0.00005138211,0.0001363165,0.000009172685,0.00001080197,0.00002207282,0.00009185168],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.009274985,"threshold_uncertainty_score":0.7252037,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2506962049","doi":"10.1039/c6sc02422j","title":"Photocatalyst size controls electron and energy transfer: selectable E/Z isomer synthesis via C–F alkenylation","year":2016,"lang":"en","type":"article","venue":"Chemical Science","topic":"Radical Photochemical Reactions","field":"Chemistry","cited_by":171,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Stillwater (Canada)","funders":"National Institute of General Medical Sciences; Oklahoma Center for the Advancement of Science and Technology; Oklahoma State University; National Institutes of Health; National Science Foundation","keywords":"Photocatalysis; Energy transfer; Electron transfer; Electron; Chemistry; Photochemistry; Combinatorial chemistry; Medicinal chemistry; Materials science; Physics; Organic chemistry; Chemical physics; Catalysis; Nuclear physics","retraction":null,"screen_n_in":null,"score":{"opus":0.004226184961593063,"gpt":0.2077391189240468,"spread":0.2035129339624537,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0001843864,0.0002052011,0.0002514074,0.00003960136,0.0001639414,0.00006606394,0.0004298974,0.0001603657,0.0009455972],"category_scores_gemma":[0.001624382,0.0001445842,0.00007562446,0.0004688146,0.001055663,0.0004164211,0.00005470559,0.0001556302,0.00002716819],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003027186,"about_ca_system_score_gemma":0.0001125939,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0000988001,"about_ca_topic_score_gemma":0.000004131631,"domain_scores_codex":[0.9978749,0.000009245448,0.0002805981,0.0006720182,0.0005041715,0.0006591025],"domain_scores_gemma":[0.9979631,0.001126864,0.00004578303,0.0003349484,0.0000942742,0.000435053],"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":[0.00004241328,0.00005792636,0.00007457136,0.0000103174,0.00001012414,9.643038e-7,0.000009343538,1.088544e-7,0.9861331,0.0002853295,0.00009050757,0.01328532],"study_design_scores_gemma":[0.0003590977,0.00001072647,0.0000303809,0.00004095719,0.00002657907,0.00001994443,0.000003132388,0.000368338,0.9924175,0.001316715,0.005172695,0.000233893],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9749907,0.0001115828,0.002107668,0.0007152872,0.00002974391,0.00007667549,0.00001655321,0.0001607871,0.02179099],"genre_scores_gemma":[0.9987546,0.00005228289,0.0001606733,0.0001326657,0.00009091562,0.0001422803,0.000002252172,0.00001882499,0.000645489],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0237639,"threshold_uncertainty_score":0.9999677,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W1885975534","doi":"10.1039/c4sc03516j","title":"Chemiluminescent probes for imaging H<sub>2</sub>S in living animals","year":2015,"lang":"en","type":"article","venue":"Chemical Science","topic":"Sulfur Compounds in Biology","field":"Biochemistry, Genetics and Molecular Biology","cited_by":167,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Cytodiagnostics (Canada)","funders":"National Center for Research Resources; National Cancer Institute; National Institutes of Health; Southern Methodist University; University of Texas at Arlington; University of Texas at Austin","keywords":"Chemiluminescence; Nanotechnology; Computer science; Chemistry; Materials science; Chromatography","retraction":null,"screen_n_in":null,"score":{"opus":0.01957959473943459,"gpt":0.2762928663327033,"spread":0.2567132715932687,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0006563178,0.0001223485,0.0001220666,0.0000450282,0.00004301529,0.00003196367,0.0004918816,0.00007499787,9.176935e-7],"category_scores_gemma":[0.00172007,0.0001134358,0.00004062499,0.0002456437,0.0005148484,0.000007631821,0.0003656262,0.00006806079,0.000004606411],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00008523005,"about_ca_system_score_gemma":0.0001892947,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000003332304,"about_ca_topic_score_gemma":0.000002806366,"domain_scores_codex":[0.9986849,0.00001278715,0.0001814236,0.0005255648,0.0001491581,0.0004461265],"domain_scores_gemma":[0.9993529,0.00003763053,0.00005063686,0.0002492284,0.0001529984,0.0001565859],"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":[0.00002129642,0.00003671891,0.01123719,0.000007441159,0.000001346375,8.334856e-7,0.00004201445,0.000002008183,0.9866915,0.00004785509,0.0003792904,0.001532535],"study_design_scores_gemma":[0.0002392166,0.00003951579,0.0009230893,0.00002209018,0.000002081107,0.00001961918,0.00006131123,0.0003068946,0.9965458,0.000242715,0.001435321,0.0001623268],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9980757,0.0003888369,0.0004196897,0.000192518,0.0001571877,0.0001859789,0.000002381777,0.00001594759,0.0005618237],"genre_scores_gemma":[0.9974559,0.00001146908,0.002047363,0.0001969435,0.0002056445,0.00005536634,0.000007759578,0.00001066571,0.000008870594],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0103141,"threshold_uncertainty_score":0.4625776,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2011589908","doi":"10.1039/c4sc00987h","title":"Photo-mechanical azobenzene cocrystals and in situ X-ray diffraction monitoring of their optically-induced crystal-to-crystal isomerisation","year":2014,"lang":"en","type":"article","venue":"Chemical Science","topic":"Photochromic and Fluorescence Chemistry","field":"Materials Science","cited_by":165,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"McGill University","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Azobenzene; Isomerization; Crystal (programming language); Materials science; Crystallography; Supramolecular chemistry; Diffraction; Crystal structure; Photochemistry; Chemistry; Optics; Physics; Organic chemistry; Catalysis; Composite material; Polymer","retraction":null,"screen_n_in":null,"score":{"opus":0.01454234764443436,"gpt":0.2538212021172829,"spread":0.2392788544728486,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0009374177,0.0001823507,0.0003067801,0.00008492952,0.00009897666,0.00008435061,0.0004935669,0.0001232045,0.00004775409],"category_scores_gemma":[0.0007501255,0.0001572629,0.00003844401,0.0004834152,0.0003880074,0.0003817044,0.0002735248,0.0001757572,0.00000914749],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001713545,"about_ca_system_score_gemma":0.0000864051,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00003785135,"about_ca_topic_score_gemma":0.000001196471,"domain_scores_codex":[0.9979603,0.0000299639,0.0004114716,0.0006213432,0.0004949303,0.0004819626],"domain_scores_gemma":[0.9989558,0.0001721823,0.0001294372,0.0003288504,0.0001004927,0.0003132257],"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":[0.00005452998,0.00007063951,0.0005132701,0.00003124007,8.232969e-7,8.063237e-7,0.000227836,0.00001039678,0.9986953,0.00002850828,0.000003508622,0.0003631673],"study_design_scores_gemma":[0.0003072158,0.00004925963,0.008677048,0.000108135,0.000003742455,0.000007215114,0.0002666303,0.0008078073,0.9893031,0.0002706589,0.00001140699,0.0001878076],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9985376,0.000008928321,0.0005851142,0.00006941821,0.0001613728,0.00021078,0.000004397931,0.00004260424,0.0003797884],"genre_scores_gemma":[0.9973182,0.000005190744,0.002494099,0.00003680263,0.0001025903,0.00002568559,0.000001474378,0.00001069724,0.000005233545],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0093922,"threshold_uncertainty_score":0.6412996,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2889272453","doi":"10.1039/c8sc02239a","title":"Chimera: enabling hierarchy based multi-objective optimization for self-driving laboratories","year":2018,"lang":"en","type":"article","venue":"Chemical Science","topic":"Advanced Multi-Objective Optimization Algorithms","field":"Computer Science","cited_by":163,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Vector Institute; University of Toronto; Canadian Institute for Advanced Research","funders":"Tata Sons; FAS Division of Science, Harvard University; Harvard University","keywords":"Chimera (genetics); Computer science; Interpretability; A priori and a posteriori; Multi-objective optimization; Mathematical optimization; Artificial intelligence; Machine learning; Mathematics","retraction":null,"screen_n_in":null,"score":{"opus":0.01339126336610078,"gpt":0.2846620514620578,"spread":0.2712707880959571,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0005523143,0.000227385,0.0001997133,0.0002216994,0.0007586118,0.000341494,0.001225204,0.00008401699,0.00001765825],"category_scores_gemma":[0.001687657,0.0002165852,0.00005522349,0.00316102,0.0008047121,0.001816726,0.0003557857,0.0001452504,0.00001038699],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003674529,"about_ca_system_score_gemma":0.0005533721,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000003065263,"about_ca_topic_score_gemma":0.000001318691,"domain_scores_codex":[0.9975287,0.00003355005,0.0002786318,0.00101804,0.0004981526,0.0006428827],"domain_scores_gemma":[0.9971504,0.0002621935,0.0001696009,0.0004593294,0.001697817,0.0002606927],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.00007115817,0.001048382,0.00129192,0.00007730538,0.00005143416,0.000008405434,0.00576337,0.1101672,0.8261968,0.0238845,0.0001541529,0.03128527],"study_design_scores_gemma":[0.0004795784,0.00004737205,0.00004956407,0.00001500047,0.000003252915,0.00000181668,0.00002479038,0.6665193,0.3321093,0.0001590789,0.000385124,0.0002058409],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"methods","genre_gemma":"methods","genre_scores_codex":[0.001757414,0.00002642765,0.996126,0.000191906,0.0005111722,0.0004578517,0.000005594417,0.0005204869,0.0004031325],"genre_scores_gemma":[0.1968819,0.000003993386,0.8025752,0.0002471721,0.0001752654,0.00007083868,0.000003744234,0.00001616555,0.00002576545],"genre_candidate":"methods","genre_consensus":"methods","teacher_disagreement_score":0.5563521,"threshold_uncertainty_score":0.8832089,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2096838085","doi":"10.1039/c5sc00648a","title":"A mechanically interlocked molecular system programmed for the delivery of an anticancer drug","year":2015,"lang":"en","type":"article","venue":"Chemical Science","topic":"Supramolecular Chemistry and Complexes","field":"Chemistry","cited_by":163,"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":"Centre National de la Recherche Scientifique; Ligue Contre le Cancer; Agence Nationale de la Recherche","keywords":"Rotaxane; Drug delivery; Anticancer drug; Chemistry; Drug; Nanotechnology; Enzyme; In vitro; Cancer cell; Combinatorial chemistry; Cancer; Biochemistry; Pharmacology; Materials science; Molecule; Biology; Supramolecular chemistry","retraction":null,"screen_n_in":null,"score":{"opus":0.02090546546891719,"gpt":0.2657103477982052,"spread":0.244804882329288,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0004662556,0.0001309718,0.0001730883,0.00001303633,0.00007547061,0.0000615703,0.00118597,0.00005910101,0.00001825309],"category_scores_gemma":[0.0003411838,0.00009237516,0.00009748158,0.0002828506,0.0006389097,0.0001000602,0.0001992224,0.0001141278,0.000001876621],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001101604,"about_ca_system_score_gemma":0.0002387154,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00003138519,"about_ca_topic_score_gemma":0.000001057472,"domain_scores_codex":[0.9985102,0.000008746652,0.000238455,0.0003925886,0.0005039541,0.0003459983],"domain_scores_gemma":[0.9987204,0.0001030192,0.00009665714,0.0005334902,0.0002879177,0.0002585176],"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":[0.00006656554,0.00006203584,0.00001571191,0.00008934584,0.00001235774,0.0000039935,0.0001245884,0.000003996078,0.9954451,0.0009797269,0.00003652176,0.003160053],"study_design_scores_gemma":[0.0003859755,0.00001826777,0.000001057053,0.00005737962,0.00003018734,0.00001973895,0.001015077,0.009578392,0.9879295,0.0004828637,0.0003540691,0.0001275232],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9961101,0.000137884,0.001963511,0.000124453,0.00005669496,0.0001325534,0.000008515163,0.00007645862,0.001389802],"genre_scores_gemma":[0.9967703,7.247453e-7,0.002975392,0.00005440473,0.00006128359,0.00008787659,0.000006312447,0.00001111108,0.00003263822],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.009574396,"threshold_uncertainty_score":0.376695,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2940430449","doi":"10.1039/c8sc05631e","title":"Diacetyl as a “traceless” visible light photosensitizer in metal-free cross-dehydrogenative coupling reactions","year":2019,"lang":"en","type":"article","venue":"Chemical Science","topic":"Catalytic C–H Functionalization Methods","field":"Chemistry","cited_by":161,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"McGill University; Centre in Green Chemistry and Catalysis","funders":"Fonds Québécois de la Recherche sur la Nature et les Technologies; Canada Foundation for Innovation; Natural Sciences and Engineering Research Council of Canada; Canada Research Chairs; McGill University","keywords":"Photosensitizer; Chemistry; Photochemistry; Coupling (piping); Metal; Combinatorial chemistry; Materials science; Organic chemistry","retraction":null,"screen_n_in":null,"score":{"opus":0.01684420041495989,"gpt":0.3135238615033902,"spread":0.2966796610884303,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0008587724,0.0001877871,0.0002522614,0.0001288652,0.0001496217,0.0001426693,0.0006330904,0.0001233383,0.004297228],"category_scores_gemma":[0.002278968,0.000184067,0.00009996679,0.001181447,0.0005368639,0.0004867311,0.0003209557,0.0003361182,0.0004178868],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004501735,"about_ca_system_score_gemma":0.0003156332,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0000916824,"about_ca_topic_score_gemma":0.000006814346,"domain_scores_codex":[0.9976189,0.000008040687,0.0003904854,0.0007495693,0.0007703821,0.000462663],"domain_scores_gemma":[0.9982947,0.0003678035,0.0001429947,0.000725229,0.0002575468,0.0002117823],"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":[0.0000153177,0.00007595027,0.001401138,0.00003210407,0.000007098649,0.000003643377,0.0003131875,0.0003384161,0.9961611,0.001527972,0.00006293836,0.00006111067],"study_design_scores_gemma":[0.0005472176,0.000005193304,0.0001337303,0.00005316523,0.000009460588,0.00002135133,0.0001629872,0.006598445,0.9841732,0.001554197,0.006504628,0.0002364354],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9442424,0.000050994,0.0001196217,0.0002537104,0.0002490571,0.0001151851,0.00001188491,0.00009572295,0.05486142],"genre_scores_gemma":[0.9916303,0.000004933413,0.001534564,0.0001207077,0.00009514226,0.00002848903,0.00001808056,0.00002160159,0.006546169],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.04831525,"threshold_uncertainty_score":0.996613,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3158331815","doi":"10.1039/d1sc00231g","title":"Beyond generative models: superfast traversal, optimization, novelty, exploration and discovery (STONED) algorithm for molecules using SELFIES","year":2021,"lang":"en","type":"article","venue":"Chemical Science","topic":"Computational Drug Discovery Methods","field":"Computer Science","cited_by":160,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Canadian Institute for Advanced Research; Vector Institute; University of Toronto","funders":"Natural Resources Canada; Natural Sciences and Engineering Research Council of Canada; Austrian Science Fund; Compute Canada; École de technologie supérieure; Schweizerischer Nationalfonds zur Förderung der Wissenschaftlichen Forschung; National Science Foundation","keywords":"Tree traversal; Novelty; Chemical space; Computer science; Generative grammar; Inverse; Interpolation (computer graphics); Algorithm; Artificial intelligence; Theoretical computer science; Drug discovery; Chemistry; Mathematics; Psychology; Biochemistry","retraction":null,"screen_n_in":null,"score":{"opus":0.04921104154932282,"gpt":0.3046049321350987,"spread":0.2553938905857759,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0004095248,0.0001576174,0.0001675387,0.00008619653,0.0003314364,0.0007954187,0.0004823904,0.00004828268,0.000002852014],"category_scores_gemma":[0.000253736,0.0001547821,0.00004849825,0.0009399132,0.0004020648,0.004241596,0.0004669416,0.00007681394,7.375976e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001254246,"about_ca_system_score_gemma":0.0005491431,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000006693852,"about_ca_topic_score_gemma":9.417683e-7,"domain_scores_codex":[0.9981909,0.00005023299,0.0002299439,0.0007485088,0.0004803127,0.0003000359],"domain_scores_gemma":[0.9988334,0.0002944264,0.00006851779,0.0002578028,0.0004156722,0.0001301654],"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":[0.000002652513,0.00005121817,0.0000021554,0.000008225819,0.000006483861,0.000002718691,0.0008619917,0.8102419,0.1198194,0.05078318,0.0000252737,0.01819477],"study_design_scores_gemma":[0.0001698904,0.00001192878,0.000003352095,0.000009925641,0.000005656262,0.00001494212,0.0001152229,0.7274465,0.237243,0.03481797,0.00001106059,0.0001505952],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"methods","genre_gemma":"methods","genre_scores_codex":[0.02392007,0.0001886423,0.9746837,0.000646999,0.0001999137,0.0001562949,0.00002228769,0.00004500911,0.0001370701],"genre_scores_gemma":[0.05888788,0.00003310675,0.9406771,0.0002525224,0.00007509896,0.00001912296,0.00002578934,0.000008817578,0.00002056523],"genre_candidate":"methods","genre_consensus":"methods","teacher_disagreement_score":0.1174235,"threshold_uncertainty_score":0.7670242,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2522565392","doi":"10.1039/c6sc03194c","title":"Porous dendritic copper: an electrocatalyst for highly selective CO<sub>2</sub> reduction to formate in water/ionic liquid electrolyte","year":2016,"lang":"en","type":"article","venue":"Chemical Science","topic":"CO2 Reduction Techniques and Catalysts","field":"Energy","cited_by":159,"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":"Agence Nationale de la Recherche","keywords":"Electrocatalyst; Electrolyte; Formate; Ionic liquid; Copper; Inorganic chemistry; Chemistry; Porosity; Chemical engineering; Materials science; Electrode; Electrochemistry; Catalysis; Organic chemistry; Physical chemistry","retraction":null,"screen_n_in":null,"score":{"opus":0.007518298860154091,"gpt":0.2511240680879017,"spread":0.2436057692277476,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0005208972,0.0002095617,0.0002377803,0.0002641939,0.0002080687,0.00006753848,0.0005180003,0.0001186524,0.00001023078],"category_scores_gemma":[0.0001128874,0.0001468619,0.00007341504,0.0008738356,0.0002623232,0.0007920967,0.00007815295,0.0001369008,0.00006570646],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000970523,"about_ca_system_score_gemma":0.0001672935,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00008260419,"about_ca_topic_score_gemma":0.00005084633,"domain_scores_codex":[0.9975413,0.00002337808,0.0003568889,0.0007180478,0.0003525165,0.001007868],"domain_scores_gemma":[0.9990294,0.00002726633,0.00006122834,0.0003664743,0.0002162756,0.000299383],"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":[0.0002748996,0.00006976802,0.000003197015,0.000008243734,0.000004139036,0.000001148195,0.0001579296,0.000006984943,0.9822454,0.001040502,0.0002779487,0.01590984],"study_design_scores_gemma":[0.0003601695,0.0005742518,0.00001980904,0.00003045774,0.000009868659,0.0001219354,0.0000287332,0.00004640697,0.9957936,0.001855172,0.000877522,0.000282106],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9969072,0.00002452322,0.001033293,0.0008527107,0.0001155151,0.0003982993,0.000004672048,0.0002507203,0.0004130253],"genre_scores_gemma":[0.9990274,0.00003344876,0.0002221466,0.000113404,0.0001657273,0.0003170019,0.00003121712,0.0000258945,0.00006378524],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01562774,"threshold_uncertainty_score":0.5988854,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2149347348","doi":"10.1039/c5sc00941c","title":"Palladium-catalyzed reductive coupling of phenols with anilines and amines: efficient conversion of phenolic lignin model monomers and analogues to cyclohexylamines","year":2015,"lang":"en","type":"article","venue":"Chemical Science","topic":"Asymmetric Hydrogenation and Catalysis","field":"Chemistry","cited_by":159,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"McGill University; Centre in Green Chemistry and Catalysis","funders":"China Scholarship Council; Fonds Québécois de la Recherche sur la Nature et les Technologies; Natural Sciences and Engineering Research Council of Canada; Canada Research Chairs","keywords":"Sodium formate; Lignin; Palladium; Phenols; Catalysis; Monomer; Chemistry; Formate; Organic chemistry; Coupling (piping); Combinatorial chemistry; Polymer chemistry; Materials science; Polymer","retraction":null,"screen_n_in":null,"score":{"opus":0.01878186085897485,"gpt":0.2454535106990652,"spread":0.2266716498400904,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001935501,0.0001218699,0.000243259,0.0001450269,0.00004154177,0.00001517076,0.0002134692,0.00006021317,0.000002608854],"category_scores_gemma":[0.0002731331,0.00009529322,0.000021763,0.0009632364,0.0007975435,0.00009309777,0.0001432296,0.00005908434,6.448835e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00005939774,"about_ca_system_score_gemma":0.00009707014,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00003957565,"about_ca_topic_score_gemma":7.617496e-7,"domain_scores_codex":[0.9988396,0.000001790346,0.0002214203,0.0003685954,0.0003882575,0.000180357],"domain_scores_gemma":[0.9990587,0.00005276554,0.0001330552,0.0001834353,0.0003090831,0.0002629339],"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":[0.00004223169,0.0000507673,0.001341702,0.00005194325,0.00001229336,3.98167e-7,0.001311949,0.002740911,0.9941047,0.00003130641,0.00001338187,0.000298444],"study_design_scores_gemma":[0.0003775684,0.00001733151,0.00005059431,0.00003073267,0.00002662655,0.000002773844,0.00196654,0.1163125,0.8810825,0.00002049771,0.000003946095,0.0001083094],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9987532,0.0001891091,0.0002961601,0.00005399437,0.000008605701,0.00006370111,0.00001436185,0.00001598108,0.0006049062],"genre_scores_gemma":[0.9987827,0.00001456067,0.001128824,0.00001109801,0.00001519808,0.00000529344,0.00001027459,0.00000632416,0.00002571516],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.1135716,"threshold_uncertainty_score":0.3885944,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2963613699","doi":"10.1039/c9sc01992h","title":"A Bayesian graph convolutional network for reliable prediction of molecular properties with uncertainty quantification","year":2019,"lang":"en","type":"article","venue":"Chemical Science","topic":"Computational Drug Discovery Methods","field":"Computer Science","cited_by":156,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Kootenay Association for Science & Technology","funders":"National Research Foundation of Korea; Ministry of Science, ICT and Future Planning; National Research Foundation","keywords":"Bayesian network; Computer science; Bayesian probability; Uncertainty quantification; Graph; Artificial intelligence; Machine learning; Theoretical computer science","retraction":null,"screen_n_in":null,"score":{"opus":0.01906070602826038,"gpt":0.250107882471045,"spread":0.2310471764427847,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0007718582,0.00008916229,0.0001242627,0.0000627729,0.00009199719,0.00006583562,0.0006907682,0.00003300378,0.00000352578],"category_scores_gemma":[0.0001150868,0.00006905269,0.0000438907,0.001073373,0.0003794115,0.0005177999,0.0001124752,0.00006269121,0.000003122438],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00007985532,"about_ca_system_score_gemma":0.0003804984,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001543516,"about_ca_topic_score_gemma":4.095442e-7,"domain_scores_codex":[0.9985059,0.00002342622,0.0002054997,0.0004651989,0.000538595,0.0002613153],"domain_scores_gemma":[0.9989853,0.0001156779,0.000113241,0.0003415287,0.0003702507,0.00007398369],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.00004267897,0.00004374959,0.001108511,0.00003754111,0.000006233351,1.564009e-7,0.00007324595,0.3444552,0.5336482,0.1197231,0.00009931764,0.0007621563],"study_design_scores_gemma":[0.0002282839,0.00007965158,0.001297634,0.00005816066,0.000004138675,0.000004480212,0.000009380125,0.7715305,0.204592,0.0219761,0.0001259689,0.0000936638],"study_design_candidate":"simulation_or_modeling","study_design_consensus":null,"genre_codex":"methods","genre_gemma":"empirical","genre_scores_codex":[0.3380388,0.00004095575,0.6610538,0.000209762,0.0001301385,0.000283496,0.00000459107,0.00003664916,0.000201833],"genre_scores_gemma":[0.8437927,8.770784e-7,0.1560646,0.00005368817,0.00002151553,0.00003532328,0.00000698882,0.000003667366,0.00002056066],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.505754,"threshold_uncertainty_score":0.2815887,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2023983892","doi":"10.1039/c2sc21740f","title":"New opportunities for organic electronics and bioelectronics: ions in action","year":2012,"lang":"en","type":"article","venue":"Chemical Science","topic":"Conducting polymers and applications","field":"Materials Science","cited_by":152,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Polytechnique Montréal","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Bioelectronics; Organic electronics; Transistor; Electrolyte; Electronics; Nanotechnology; Materials science; Organic semiconductor; Molecular electronics; Electrochemistry; Ion; Ionic bonding; Chemistry; Molecule; Optoelectronics; Electrical engineering; Biosensor; Electrode; Voltage; Engineering; Organic chemistry","retraction":null,"screen_n_in":null,"score":{"opus":0.0872504009205851,"gpt":0.3183245943899035,"spread":0.2310741934693184,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0003266277,0.00005693279,0.00006456382,0.00003952809,0.0001291764,0.00005032422,0.0001657132,0.00002922494,0.00008796988],"category_scores_gemma":[0.00008721539,0.00005144682,0.00001147384,0.0002545387,0.0001838759,0.0002946075,0.00005268852,0.0000588463,0.000006414321],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001016342,"about_ca_system_score_gemma":0.0002549815,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0000248117,"about_ca_topic_score_gemma":0.00001395261,"domain_scores_codex":[0.9992069,0.000004303664,0.00009572183,0.00017591,0.00009867323,0.0004185052],"domain_scores_gemma":[0.99963,0.00005068091,0.00003332616,0.0001109271,0.00002104923,0.0001540448],"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":[0.000001818134,0.00001308626,0.00005428166,0.000002563946,2.153042e-7,1.560654e-8,0.00009398636,8.241518e-8,0.9860138,0.005556559,0.0001541419,0.008109496],"study_design_scores_gemma":[0.00008291386,0.00001341862,0.00007283627,0.000003483579,0.00000337238,0.000005591477,0.000171667,0.0000383911,0.9924847,0.001242849,0.005807975,0.00007283024],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9967788,0.0004074149,0.001403235,0.0009992896,0.0000858597,0.0000987431,0.000001934866,0.00002918215,0.0001955582],"genre_scores_gemma":[0.9975484,0.00004713909,0.001954553,0.00007599385,0.00009073499,0.0000201957,0.00000152397,0.000004386105,0.0002570665],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.008036666,"threshold_uncertainty_score":0.2097941,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2152561290","doi":"10.1039/c4sc03675a","title":"A family of N-heterocyclic carbene-stabilized borenium ions for metal-free imine hydrogenation catalysis","year":2015,"lang":"en","type":"article","venue":"Chemical Science","topic":"Asymmetric Hydrogenation and Catalysis","field":"Chemistry","cited_by":145,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Toronto; Toronto Public Health","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Imine; Carbene; Catalysis; Chemistry; Metal; Ion; Polymer chemistry; Organic chemistry; Combinatorial chemistry","retraction":null,"screen_n_in":null,"score":{"opus":0.03544266474088405,"gpt":0.2806908043218853,"spread":0.2452481395810012,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0004370485,0.0001629866,0.000315417,0.000209677,0.00008916124,0.00003124022,0.0009837556,0.0001028251,0.00005088472],"category_scores_gemma":[0.002452828,0.0001440003,0.0002247525,0.001851844,0.0004991431,0.0002342971,0.0002391692,0.00008716702,0.000009079551],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002474987,"about_ca_system_score_gemma":0.0001445463,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00009042049,"about_ca_topic_score_gemma":0.000006844587,"domain_scores_codex":[0.9978536,0.000007549821,0.0004325619,0.0004995001,0.0008522652,0.0003545714],"domain_scores_gemma":[0.9981261,0.0001262167,0.0002079174,0.0007159396,0.0004675792,0.0003562059],"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":[0.00002035252,0.0001076166,0.0001167987,0.00002204837,0.00002915661,3.437895e-7,0.0001497956,0.00002601813,0.9971222,0.0001840397,0.0002309077,0.001990765],"study_design_scores_gemma":[0.0009115133,0.00001290504,0.00001418808,0.000006228089,0.0001167099,0.000002686145,0.0002175641,0.006591249,0.9899672,0.0005774919,0.001411571,0.0001706471],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9891917,0.0002486279,0.00102368,0.0001968179,0.00005276073,0.0001029663,0.00008073089,0.00006556768,0.009037128],"genre_scores_gemma":[0.997759,0.000006275029,0.001708759,0.00004800972,0.00005449939,0.00007321473,0.0001428468,0.00001314963,0.0001942025],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.008842926,"threshold_uncertainty_score":0.5872161,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2947950688","doi":"10.1039/c9sc04503a","title":"Scaffold-based molecular design with a graph generative model","year":2019,"lang":"en","type":"article","venue":"Chemical Science","topic":"Computational Drug Discovery Methods","field":"Computer Science","cited_by":145,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Kootenay Association for Science & Technology","funders":"Ministry of Science and ICT, South Korea; National Research Foundation of Korea; National Research Foundation","keywords":"Generative model; Generative grammar; Graph; Scaffold; Extension (predicate logic); Simple (philosophy); Process (computing)","retraction":null,"screen_n_in":null,"score":{"opus":0.02065093017960657,"gpt":0.2719345199321079,"spread":0.2512835897525014,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0006455199,0.0001437766,0.000135408,0.0001170648,0.0000867291,0.0002115461,0.001515645,0.00003149396,0.000006743418],"category_scores_gemma":[0.000071335,0.0001113575,0.00004558213,0.001587951,0.0003625381,0.0006465568,0.00024854,0.0000942194,0.00003557734],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00009894037,"about_ca_system_score_gemma":0.0007803032,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000002681802,"about_ca_topic_score_gemma":8.919988e-8,"domain_scores_codex":[0.9979046,0.00005615004,0.0001299266,0.0007121924,0.0008291125,0.0003679969],"domain_scores_gemma":[0.9988845,0.0001814621,0.00005761467,0.0005201278,0.0001754619,0.0001808296],"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":[0.000005688277,0.00002430564,0.00002089658,0.00000240366,0.000001630869,0.000003281242,0.00005836632,0.5413296,0.4282912,0.02953676,0.0000163079,0.0007095506],"study_design_scores_gemma":[0.0001324276,0.00002625124,0.00002891159,0.000008830908,0.000001201893,0.000003139642,0.000001330997,0.5504443,0.4351703,0.01407344,0.000002936073,0.0001069594],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"methods","genre_gemma":"empirical","genre_scores_codex":[0.3007217,0.00001324838,0.6978506,0.0003159543,0.00003921872,0.0001546332,5.772114e-7,0.00006139853,0.0008426877],"genre_scores_gemma":[0.5297579,1.289084e-7,0.4697458,0.0004656492,0.000004656785,0.00001034024,3.993383e-7,0.000003635739,0.00001149234],"genre_candidate":"methods","genre_consensus":null,"teacher_disagreement_score":0.2290362,"threshold_uncertainty_score":0.4541029,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2754946170","doi":"10.1039/c7sc03515b","title":"An acidic pH independent piperazine–TPE AIEgen as a unique bioprobe for lysosome tracing","year":2017,"lang":"en","type":"article","venue":"Chemical Science","topic":"Luminescence and Fluorescent Materials","field":"Materials Science","cited_by":143,"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":"Division of Chemistry; Fundamental Research Funds for the Central Universities; National Key Research and Development Program of China; Hong Kong University of Science and Technology; University Grants Committee; Natural Science Foundation of Guangdong Province; Guangdong Province Introduction of Innovative R&D Team; Innovation and Technology Commission; China Postdoctoral Science Foundation; National Science Foundation","keywords":"Piperazine; Chemistry; Tracing; Lysosome; Combinatorial chemistry; Biochemistry; Organic chemistry; Computer science; Programming language; Enzyme","retraction":null,"screen_n_in":null,"score":{"opus":0.02118797101152963,"gpt":0.3158252226222519,"spread":0.2946372516107223,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["scholarly_communication"],"consensus_categories":[],"category_scores_codex":[0.001396495,0.0002257031,0.0002935035,0.00007287765,0.0009855224,0.001160658,0.002523211,0.0001319567,0.0002976681],"category_scores_gemma":[0.00071676,0.0001794576,0.00007004843,0.0001236171,0.001738812,0.001755184,0.000337171,0.00009619941,0.0002625449],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001232048,"about_ca_system_score_gemma":0.0002634022,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001634363,"about_ca_topic_score_gemma":0.000009112895,"domain_scores_codex":[0.9973728,0.00002209345,0.0003432806,0.0008661207,0.0006057218,0.0007899585],"domain_scores_gemma":[0.9980671,0.00003468557,0.0002276786,0.001056956,0.0002047426,0.000408882],"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":[0.00004626541,0.00008726578,0.0005555501,0.00003332597,0.000001137318,0.00000626521,0.0002481778,0.000001032553,0.9972661,0.0009944531,0.0000776852,0.0006827001],"study_design_scores_gemma":[0.0003949392,0.00008371208,0.00135646,0.00006000627,0.0000105985,0.00002295573,0.00005961812,0.0001942128,0.9954783,0.001817991,0.0002355427,0.0002856906],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9969503,0.00002487571,0.000493001,0.0005392637,0.0006795048,0.0004582079,0.00002640671,0.0001157798,0.0007126385],"genre_scores_gemma":[0.9966713,0.000007904517,0.002432459,0.0002976023,0.0003664987,0.00007512874,0.000007170829,0.00001804383,0.0001239487],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.00218604,"threshold_uncertainty_score":0.9998763,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3043854701","doi":"10.1039/d0sc03189e","title":"A kinetic description of how interfaces accelerate reactions in micro-compartments","year":2020,"lang":"en","type":"article","venue":"Chemical Science","topic":"Mass Spectrometry Techniques and Applications","field":"Chemistry","cited_by":142,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"","funders":"Lawrence Berkeley National Laboratory; Basic Energy Sciences; Natural Sciences and Engineering Research Council of Canada; U.S. Department of Energy","keywords":"Kinetic energy; Computer science; Chemistry; Compartment (ship); Nanotechnology; Chemical physics; Materials science; Physics; Geology; Classical mechanics; Oceanography","retraction":null,"screen_n_in":null,"score":{"opus":0.04896477012736727,"gpt":0.2824348637274551,"spread":0.2334700936000879,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00005344962,0.00006341097,0.00009573566,0.00003422482,0.00002948508,0.0000395272,0.0003394931,0.00003168704,0.0004491075],"category_scores_gemma":[0.00007228008,0.00005925273,0.00002115664,0.0006754344,0.0002040212,0.0001232305,0.00008757159,0.0001159586,0.000005658948],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00007306507,"about_ca_system_score_gemma":0.00002256293,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001964163,"about_ca_topic_score_gemma":8.094578e-7,"domain_scores_codex":[0.999324,0.00000224528,0.0001406246,0.0002373508,0.0001409156,0.000154885],"domain_scores_gemma":[0.9996629,0.00001389602,0.00006576561,0.0001385169,0.00003405263,0.00008482151],"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":[0.000003871437,0.00004362823,0.00156314,0.00002318206,8.044323e-7,2.376833e-7,0.0000538756,0.000001100205,0.9973903,0.0005019534,0.0001628939,0.0002550402],"study_design_scores_gemma":[0.00008355558,0.000007563929,0.0004163184,0.00002160969,0.000002205612,0.000001275701,0.00004892988,0.0006787441,0.9963231,0.0005295177,0.001827531,0.00005963865],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9853585,0.00001740148,0.0001764543,0.001439029,0.000006929951,0.00004832659,0.000005073698,0.00004840333,0.01289982],"genre_scores_gemma":[0.996769,0.00001083626,0.00306005,0.00004733507,0.00001795845,0.00002283692,0.000003450092,0.000002949855,0.00006564827],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01283417,"threshold_uncertainty_score":0.4917412,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2134749573","doi":"10.1039/c3sc50800e","title":"Synthesis and electronic structure of a two dimensional π-conjugated polythiophene","year":2013,"lang":"en","type":"article","venue":"Chemical Science","topic":"Surface Chemistry and Catalysis","field":"Engineering","cited_by":142,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"McGill University; Institut National de la Recherche Scientifique","funders":"Natural Sciences and Engineering Research Council of Canada; Fonds Québécois de la Recherche sur la Nature et les Technologies; Ministère du Développement Économique, de l’Innovation et de l’Exportation; Alexander von Humboldt-Stiftung","keywords":"Conjugated system; Polythiophene; X-ray photoelectron spectroscopy; Scanning tunneling microscope; Polymer; Monomer; Polymerization; Electronic structure; Materials science; Scanning tunneling spectroscopy; Fermi level; Photochemistry; Chemistry; Polymer chemistry; Chemical physics; Nanotechnology; Conductive polymer; Chemical engineering; Computational chemistry; Organic chemistry; Physics","retraction":null,"screen_n_in":null,"score":{"opus":0.002840197997316754,"gpt":0.1858320994966156,"spread":0.1829919014992989,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00004313412,0.00007403856,0.00009908883,0.00001827988,0.00002880796,0.00001652551,0.0001557876,0.00003361284,0.0002905545],"category_scores_gemma":[0.00007352987,0.00006216791,0.00001846092,0.0003026584,0.0002861653,0.000119026,0.00004190187,0.00008400477,0.000005914794],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0000353923,"about_ca_system_score_gemma":0.0000235218,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001452586,"about_ca_topic_score_gemma":3.588855e-7,"domain_scores_codex":[0.9993799,0.000001828751,0.00009000413,0.0001496083,0.0001529236,0.0002257716],"domain_scores_gemma":[0.9996856,0.00004926814,0.00001377338,0.0001253167,0.00003493362,0.00009108958],"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":[7.323255e-7,0.000003111111,0.0001256434,0.00001125836,0.000005221715,1.24735e-7,0.00001667793,0.000263973,0.9986989,0.00002485209,0.00002533684,0.0008241913],"study_design_scores_gemma":[0.00005506605,0.000001894334,0.0003304828,0.00000819684,0.000007369807,0.000006312488,0.000007166084,0.004149354,0.9946669,0.0006847963,0.000006046661,0.00007637586],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9993615,0.0001655332,0.00000721072,0.00003456488,0.00001641277,0.00002821943,0.000003439269,0.00004015042,0.0003430324],"genre_scores_gemma":[0.9997247,0.000003537966,0.0002284422,0.00001459858,0.00001149907,0.000002997523,0.000001438513,0.000004486516,0.000008228345],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004031939,"threshold_uncertainty_score":0.3181368,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2771893430","doi":"10.1039/c7sc03628k","title":"Efficient prediction of reaction paths through molecular graph and reaction network analysis","year":2017,"lang":"en","type":"article","venue":"Chemical Science","topic":"Computational Drug Discovery Methods","field":"Computer Science","cited_by":140,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Kootenay Association for Science & Technology","funders":"National Supercomputing Center, Korea Institute of Science and Technology Information; National Research Foundation of Korea; Korea Institute of Science and Technology Information; Ministry of Science, ICT and Future Planning","keywords":"Power graph analysis; Computer science; Graph; Network analysis; Chemistry; Computational chemistry; Combinatorial chemistry; Theoretical computer science; Engineering","retraction":null,"screen_n_in":null,"score":{"opus":0.01880021375645944,"gpt":0.2991979430300002,"spread":0.2803977292735407,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000951081,0.0000930495,0.000158254,0.000103909,0.0003536138,0.0001745573,0.0007647692,0.00004513319,7.735698e-7],"category_scores_gemma":[0.0003603295,0.00008593519,0.00008194199,0.001208666,0.0005551158,0.0006172479,0.000407426,0.00009972105,0.000001182341],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00006918836,"about_ca_system_score_gemma":0.00006820923,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00007085925,"about_ca_topic_score_gemma":9.129996e-7,"domain_scores_codex":[0.9984166,0.00003994106,0.0002133809,0.0005223161,0.0005845604,0.0002231897],"domain_scores_gemma":[0.9987127,0.0001020678,0.0002578767,0.0006814895,0.0001571571,0.00008866929],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.000007782727,0.00005650129,0.001666071,0.000008024882,0.00003108174,0.00000224086,0.0001971059,0.02593617,0.9337264,0.027726,0.00001540081,0.01062726],"study_design_scores_gemma":[0.0001494691,0.00002711555,0.160312,0.00002120247,0.0000650892,0.000008907565,0.00001025577,0.6843469,0.1279412,0.02694423,0.00004809694,0.0001255876],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.6300076,0.00002989789,0.3686312,0.0001457819,0.0001838456,0.00005689304,0.000001617847,0.00002864516,0.0009144961],"genre_scores_gemma":[0.9549626,0.000008190735,0.04494948,0.00002869166,0.00003843219,0.000004969781,0.000001882687,0.000002448822,0.000003371901],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.8057852,"threshold_uncertainty_score":0.3504336,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2096547860","doi":"10.1039/c4sc02410a","title":"Optical and electronic properties of air-stable organoboron compounds with strongly electron-accepting bis(fluoromesityl)boryl groups","year":2014,"lang":"en","type":"article","venue":"Chemical Science","topic":"Organoboron and organosilicon chemistry","field":"Chemistry","cited_by":136,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Toronto; Toronto Public Health","funders":"Natural Sciences and Engineering Research Council of Canada; Solar Technologies go Hybrid; Alexander von Humboldt-Stiftung","keywords":"Organoboron compounds; Electron; Chemistry; Medicinal chemistry; Boron; Physics; Organic chemistry; Nuclear physics","retraction":null,"screen_n_in":null,"score":{"opus":0.006013646562264401,"gpt":0.2006895278757592,"spread":0.1946758813134948,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0003584629,0.0003198908,0.0004106238,0.00004793537,0.0002211997,0.00009437314,0.0007280171,0.0001617982,0.0002059831],"category_scores_gemma":[0.0002310111,0.0002551014,0.00004626411,0.0005146628,0.001728475,0.0003466172,0.0002877986,0.0004682009,0.000006310799],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002879504,"about_ca_system_score_gemma":0.0004786176,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00002228023,"about_ca_topic_score_gemma":0.000006980111,"domain_scores_codex":[0.997179,0.00001118658,0.0003505866,0.0007645265,0.0006501215,0.001044575],"domain_scores_gemma":[0.998789,0.00006766364,0.0001503701,0.0004964165,0.0001587889,0.0003377676],"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":[0.00005820772,0.000104333,0.004509113,0.0001881673,0.00001274655,7.898666e-7,0.00009860459,0.000003038322,0.9937028,0.0009228354,0.00002282945,0.0003764967],"study_design_scores_gemma":[0.000628437,0.00008567369,0.0005089756,0.00008479599,0.00002906194,0.00004789463,0.0001696191,0.0002692203,0.9975426,0.0000465056,0.0002290621,0.0003582201],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9933369,0.0002630844,0.00005992587,0.0001912563,0.00001757391,0.00006627225,0.000002567499,0.0001312703,0.005931178],"genre_scores_gemma":[0.9991626,0.00001997416,0.0004806806,0.00005527306,0.0001119216,0.000009157367,0.000005812974,0.00003664216,0.0001179498],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.005825717,"threshold_uncertainty_score":0.9999901,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2158240264","doi":"10.1039/c5sc00685f","title":"Water diffusion in atmospherically relevant α-pinene secondary organic material","year":2015,"lang":"en","type":"article","venue":"Chemical Science","topic":"Atmospheric chemistry and aerosols","field":"Earth and Planetary Sciences","cited_by":136,"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":"Engineering and Physical Sciences Research Council; Natural Environment Research Council; Sight Research UK","keywords":"Pinene; Aerosol; Diffusion; Environmental chemistry; Chemistry; Environmental science; Organic chemistry; Thermodynamics; Physics","retraction":null,"screen_n_in":null,"score":{"opus":0.00941238413740318,"gpt":0.1960375527716736,"spread":0.1866251686342705,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0004112801,0.00013863,0.0001653423,0.000003318716,0.00008427884,0.00009173551,0.0005325914,0.00007862255,0.00581546],"category_scores_gemma":[0.0001367979,0.00008943817,0.00002631654,0.0004236843,0.0004657381,0.0003106868,0.00009382769,0.0001729401,0.0003339038],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00003273854,"about_ca_system_score_gemma":0.0001800085,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002478594,"about_ca_topic_score_gemma":0.00002956657,"domain_scores_codex":[0.9983529,0.00001490557,0.000236252,0.0004295412,0.0004278121,0.0005386128],"domain_scores_gemma":[0.9992971,0.00002643196,0.00003423272,0.0002090215,0.00004451228,0.000388708],"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":[0.0000459493,0.0000231304,0.01353422,0.000006762536,7.330356e-7,0.00002415759,0.0001653847,0.00004647165,0.9826218,0.000002397086,0.000168814,0.003360192],"study_design_scores_gemma":[0.0004509326,0.00005128097,0.01397104,0.00001675966,0.000002512172,0.00003656934,0.0001032298,0.001795814,0.9804762,0.0005988571,0.002242937,0.0002538749],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9912304,0.00003646532,0.00004054555,0.0002966964,0.000294082,0.00006977974,0.000006284289,0.00004536317,0.007980389],"genre_scores_gemma":[0.9973926,0.000006263132,0.00196202,0.000202044,0.0001474532,9.07377e-7,0.00003419717,0.000003119487,0.0002514244],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.007728964,"threshold_uncertainty_score":0.9950933,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2589005568","doi":"10.1039/c7sc00433h","title":"Advanced electroanalytical chemistry at nanoelectrodes","year":2017,"lang":"en","type":"article","venue":"Chemical Science","topic":"Electrochemical Analysis and Applications","field":"Chemistry","cited_by":135,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Western University","funders":"Science Fund for Creative Research Groups; Natural Sciences and Engineering Research Council of Canada; National Natural Science Foundation of China","keywords":"Nanotechnology; Chemistry; Materials science","retraction":null,"screen_n_in":null,"score":{"opus":0.00686347294865162,"gpt":0.2657035228438396,"spread":0.258840049895188,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0001524217,0.0001975114,0.0002370107,0.00001587305,0.00116106,0.0002149816,0.001906485,0.000111312,0.001051698],"category_scores_gemma":[0.0005436208,0.0001696531,0.0001476445,0.0002280231,0.001448212,0.0002178572,0.0004853297,0.00028994,0.0001363525],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003645042,"about_ca_system_score_gemma":0.00012018,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000007116324,"about_ca_topic_score_gemma":0.000001879166,"domain_scores_codex":[0.99768,0.000001599136,0.0002452318,0.0007736355,0.0005256551,0.0007738977],"domain_scores_gemma":[0.9982028,0.00005071014,0.0001722944,0.001101781,0.00009921743,0.0003731668],"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":[0.00001284509,0.00005584089,0.0003021968,0.00001358891,0.000009225812,0.000001380035,0.000005283128,5.219829e-7,0.995793,0.0006851135,0.0001827966,0.002938185],"study_design_scores_gemma":[0.000179731,0.000003644459,0.00004795107,0.00001240906,0.00002478872,0.00001402233,0.00000377874,0.0009888085,0.9917098,0.001779067,0.005001635,0.0002343866],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.896373,0.00008112357,0.00004985897,0.0008312949,0.000007321959,0.00002545511,0.000003548761,0.00008356888,0.1025448],"genre_scores_gemma":[0.994599,0.00002780539,0.0004641262,0.00007178166,0.0001406152,0.00003465636,0.00001346809,0.00001312693,0.004635365],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.09822602,"threshold_uncertainty_score":0.9998615,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null}]}