{"meta":{"page":1,"per_page":50,"max_per_page":100,"total":31,"total_is_capped":false,"direct_labels_cover":0,"predictions_cover":31,"direct_label_status":"direct model label, unvalidated","prediction_status":"machine_predicted_unvalidated (Codex and Gemma teacher distillation)","score_status":"score_only:v0-immature-baseline (scores rank; they never assert a category)","snapshot":{"source":"OpenAlex, pinned release, all 482 partitions","release":"2026-06-24","frame_built":"2026-07-12","author_layer_release":"2026-06-26"},"query_hash":"f0527aa343fa","filters":{"venue":"Molecular Catalysis"}},"results":[{"id":"W3179454888","doi":"10.1016/j.mcat.2021.111725","title":"Insights on the Catalytic Active Site for CO2 Reduction on Copper-based Catalyst: A DFT study","year":2021,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"CO2 Reduction Techniques and Catalysts","field":"Energy","cited_by":37,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Ottawa","funders":"Natural Science Foundation of Hebei Province; National Natural Science Foundation of China","keywords":"Catalysis; Copper; Reduction (mathematics); Active site; Chemistry; Organic chemistry; Mathematics","authors":[{"name":"Yani Guan","is_ca":false},{"name":"Wei Suo","is_ca":false},{"name":"Zisheng Zhang","is_ca":true},{"name":"Yanji Wang","is_ca":false},{"name":"Shujuan Sun","is_ca":false},{"name":"Guihua Liu","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01527991060709014,"gpt":0.2552972273117857,"spread":0.2400173167046956,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0002098482,0.0004268551,0.0004807752,0.0003240411,0.0004488526,0.0001302143,0.000360541,0.0001575858,0.00008288441],"category_scores_gemma":[0.0002423898,0.0003402017,0.0005893902,0.001288584,0.000101488,0.0001051192,0.00009070978,0.0003088076,0.0001957984],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003443833,"about_ca_system_score_gemma":0.0001779958,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0008112988,"about_ca_topic_score_gemma":0.0004610356,"domain_scores_codex":[0.9972807,0.0002418628,0.0004514895,0.0009964554,0.0006478223,0.0003816551],"domain_scores_gemma":[0.9973089,0.0001521744,0.0002201493,0.001803598,0.0003754669,0.0001397109],"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":[0.001868877,0.008616984,0.00005206537,0.0001552794,0.00405533,0.0008779799,0.008045332,0.02327045,0.8638289,0.022964,0.01326365,0.05300118],"study_design_scores_gemma":[0.0009398347,0.0005475499,0.0001060393,0.00004027252,0.0006633301,0.00002239019,0.001966808,0.0005106168,0.9809854,0.0005061519,0.01326156,0.0004500737],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9914745,0.0001726438,0.001100408,0.001871817,0.0002917669,0.001177603,0.00007276597,0.0002578676,0.003580601],"genre_scores_gemma":[0.9952067,0.000006762548,0.00008675682,0.0005840825,0.0001314234,0.0009623254,0.001753697,0.00008834858,0.001179914],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.1171565,"threshold_uncertainty_score":0.999905,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2987839628","doi":"10.1016/j.mcat.2019.110606","title":"Mechanistic insights of methane conversion to ethylene over gallium oxide and gallium nitride using density functional theory","year":2019,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Catalytic Processes in Materials Science","field":"Materials Science","cited_by":29,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"McGill University","funders":"Fonds de recherche du Québec – Nature et technologies; Compute Canada","keywords":"Density functional theory; Catalysis; Exothermic reaction; Gallium; Ethylene; Methane; Chemistry; Oxidative coupling of methane; Photochemistry; Adsorption; Activation energy; Oxide; Reaction mechanism; Vacancy defect; Physical chemistry; Computational chemistry; Crystallography; Organic chemistry","authors":[{"name":"Vishnu Chaudhari","is_ca":true},{"name":"Kanchan Dutta","is_ca":true},{"name":"Chao‐Jun Li","is_ca":true},{"name":"Jan Kopyscinski","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.008725556192518722,"gpt":0.2267972375163694,"spread":0.2180716813238507,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.001075917,0.0002332887,0.0004544853,0.0002465955,0.00007907587,0.00007345156,0.0003787377,0.000103065,0.0005247561],"category_scores_gemma":[0.0004179871,0.0002184132,0.00009575997,0.0005224765,0.0001755638,0.0002557905,0.0005147393,0.00008078836,0.0001899861],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001138916,"about_ca_system_score_gemma":0.0001427313,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003361789,"about_ca_topic_score_gemma":0.00001223027,"domain_scores_codex":[0.9977389,0.0001422311,0.0003863388,0.0006910813,0.0007190058,0.0003224298],"domain_scores_gemma":[0.9985424,0.0001585729,0.0002247817,0.0006501009,0.0002495799,0.0001745864],"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":[0.000140426,0.00003462107,0.0001386878,0.0001235099,0.00002611023,0.000020943,0.0001365091,0.0008199928,0.9970485,0.00148313,0.00000776946,0.0000197879],"study_design_scores_gemma":[0.0003030369,0.00004841794,0.0006502325,0.00004457624,0.0001771579,0.00002793759,0.00008290011,0.000850035,0.994049,0.003479383,0.00003073856,0.0002566055],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9085634,0.0001778299,0.09046277,0.00002520341,0.0004051533,0.0002359735,0.00002105294,0.00003641455,0.00007218644],"genre_scores_gemma":[0.9943503,0.000007190586,0.005174514,0.0002869819,0.00002354041,0.000007036824,0.00002517261,0.00002304438,0.0001022041],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0857869,"threshold_uncertainty_score":0.890663,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4200144107","doi":"10.1016/j.mcat.2021.112034","title":"Synthesis of sulfonated hierarchical carbons and theirs application on the production of furfural from wheat straw","year":2021,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Catalysis for Biomass Conversion","field":"Engineering","cited_by":23,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of New Brunswick","funders":"National Natural Science Foundation of China","keywords":"Furfural; Chemistry; Catalysis; Activated carbon; Straw; Sulfanilic acid; Potassium carbonate; Urea; Sucrose; Organic chemistry; Nuclear chemistry; Inorganic chemistry","authors":[{"name":"Tingwei Zhang","is_ca":false},{"name":"Haiying Wei","is_ca":false},{"name":"Junlong Gao","is_ca":false},{"name":"Sihong Chen","is_ca":false},{"name":"Yongcan Jin","is_ca":false},{"name":"Chao Deng","is_ca":false},{"name":"Shufang Wu","is_ca":false},{"name":"Huining Xiao","is_ca":true},{"name":"Wenzhi Li","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.004145753762075507,"gpt":0.1727650602009257,"spread":0.1686193064388501,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00008754908,0.0001212901,0.0002262182,0.00009494852,0.00003178847,0.000009974768,0.0001148997,0.00006842807,0.00001767176],"category_scores_gemma":[0.0001305845,0.0001002702,0.0001355449,0.0004723111,0.00008895276,0.00003646503,0.0000458547,0.00009078219,0.000003439744],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00003532488,"about_ca_system_score_gemma":0.0000141966,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001735427,"about_ca_topic_score_gemma":0.00004204896,"domain_scores_codex":[0.9991519,0.0000518888,0.0002213409,0.0002408675,0.0002304234,0.000103569],"domain_scores_gemma":[0.9991525,0.0001196771,0.00005358615,0.0005742642,0.00006502964,0.00003490935],"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":[0.00001133942,0.00003209871,0.000258824,0.00002887908,0.0002982381,0.000003493474,0.0001451352,0.001059632,0.9928271,0.0001832764,0.00003952701,0.005112418],"study_design_scores_gemma":[0.00005765448,0.000007524521,0.001845289,0.00002678746,0.0002657349,0.000002477292,0.0001478009,0.005560186,0.9918104,0.0001180948,0.00006724244,0.0000908154],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9976224,0.0004278939,0.0009684644,0.0005555949,0.00004588757,0.0001109909,0.00004928455,0.00003726148,0.0001821947],"genre_scores_gemma":[0.9995161,0.00003797307,0.0001577244,0.00001014821,0.00001267704,0.00002379596,0.0002117768,0.00001940067,0.00001044391],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.005021602,"threshold_uncertainty_score":0.4088902,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4385847611","doi":"10.1016/j.mcat.2023.113470","title":"Facile one-pot synthesis of plasmonic gold nanoparticles decorated porphyrin-metal organic framework for photocatalytic hydrogen evolution","year":2023,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Advanced Photocatalysis Techniques","field":"Energy","cited_by":23,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Université Laval","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Photocatalysis; Porphyrin; Materials science; Crystallinity; Nanocomposite; Metalation; Catalysis; Nanoparticle; Surface modification; Photochemistry; Chemical engineering; Plasmon; Nanotechnology; Chemistry; Organic chemistry; Composite material","authors":[{"name":"Edward F. Pena","is_ca":true},{"name":"Jorge Becerra","is_ca":true},{"name":"Vishnu Nair Gopalakrishnan","is_ca":true},{"name":"Trong‐On Do","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01440082955816111,"gpt":0.2539262119835211,"spread":0.23952538242536,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0004478379,0.0004740201,0.000897797,0.0006808756,0.0001431937,0.00003949311,0.0007327513,0.000333427,0.0001524429],"category_scores_gemma":[0.001260308,0.0005249681,0.0006602174,0.003615016,0.0001896205,0.0002454449,0.0002522431,0.0002111926,0.0004367995],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003101971,"about_ca_system_score_gemma":0.0001209528,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004494759,"about_ca_topic_score_gemma":0.0002008765,"domain_scores_codex":[0.9967012,0.000117117,0.0009033393,0.0008999615,0.0006096988,0.000768706],"domain_scores_gemma":[0.9970781,0.0004745552,0.0004654015,0.001533303,0.0002576875,0.0001909258],"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":[0.00009993588,0.0002074899,0.000134899,0.0001096907,0.0008795775,0.00002733376,0.0001064499,0.005593991,0.9876611,0.00292764,0.00008753931,0.002164404],"study_design_scores_gemma":[0.0002895983,0.0001066946,0.00009129319,0.00008452299,0.0009845075,0.000006322937,0.0001417706,0.006276231,0.9699702,0.0212009,0.0003285354,0.0005193937],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9508822,0.0002553951,0.04650727,0.00006319999,0.00005269354,0.0009981418,0.0001669061,0.0008537452,0.0002204594],"genre_scores_gemma":[0.9895394,0.00003870754,0.007897296,0.00003675949,0.00002544204,0.001342243,0.0007380352,0.0001688375,0.0002132538],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.03865724,"threshold_uncertainty_score":0.9997202,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4392465577","doi":"10.1016/j.mcat.2024.113992","title":"Silicotungstic acid catalyst supported onto functionalized halloysite nanotubes (HNTs) utilized for the production of 5-hydroxymethylfurfural (5-HMF) from fructose","year":2024,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Catalysis for Biomass Conversion","field":"Engineering","cited_by":19,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Concordia University","funders":"Iran Polymer and Petrochemical Institute; Iran National Science Foundation; National Natural Science Foundation of China","keywords":"Silicotungstic acid; Catalysis; Chemistry; Halloysite; Fructose; Yield (engineering); Nuclear chemistry; Inorganic chemistry; Organic chemistry; Chemical engineering; Materials science","authors":[{"name":"Zahra Hosseini","is_ca":false},{"name":"Mohammad Kazemeini","is_ca":false},{"name":"Samahe Sadjadi","is_ca":false},{"name":"Sina Pourebrahimi","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.008091240528809284,"gpt":0.2150810560519145,"spread":0.2069898155231053,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0003701503,0.0004255087,0.0005813302,0.0003445731,0.0001445489,0.0001091785,0.0004324575,0.0001849144,0.0003579133],"category_scores_gemma":[0.0002739119,0.000352843,0.000886457,0.001251497,0.0001493198,0.0003096844,0.0001049049,0.0001873745,0.0001072883],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002135943,"about_ca_system_score_gemma":0.00006660519,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000677219,"about_ca_topic_score_gemma":0.0002863007,"domain_scores_codex":[0.9975822,0.0000570478,0.0006575606,0.0007136395,0.0005919778,0.0003975671],"domain_scores_gemma":[0.9982389,0.0002614534,0.00009598475,0.001113354,0.0001780568,0.0001122617],"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":[0.00008831244,0.00004404908,0.00008492708,0.0002163173,0.002633458,0.0000181041,0.0004893517,0.003513863,0.9841726,0.00005833722,0.00133999,0.007340632],"study_design_scores_gemma":[0.0005139755,0.00003023252,0.0003215547,0.00007639768,0.002896755,0.00001346049,0.0002061048,0.0742364,0.9111105,0.0001690366,0.01002455,0.0004010548],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9519687,0.01547686,0.02845281,0.0003922653,0.001795554,0.0008300332,0.0003934204,0.0005941415,0.00009626126],"genre_scores_gemma":[0.9944832,0.0001082169,0.0006959437,0.00003432343,0.0001418324,0.0002282086,0.003710207,0.0001142032,0.0004838567],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.07306218,"threshold_uncertainty_score":0.9998924,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4313598179","doi":"10.1016/j.mcat.2022.112913","title":"Promoting catalytic performance by balancing acid and redox sites on Mn3O4–Mn2P2O7/TiO2 for selective catalytic reduction of NO by NH3 at low temperature","year":2023,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Catalytic Processes in Materials Science","field":"Materials Science","cited_by":14,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Alberta","funders":"Natural Science Foundation of Anhui Province","keywords":"Catalysis; Redox; NOx; Chemistry; Selective catalytic reduction; Inorganic chemistry; Dehydrogenation; Adsorption; Specific surface area; Chemical engineering; Organic chemistry","authors":[{"name":"Yong Jia","is_ca":false},{"name":"Ruizi Zheng","is_ca":false},{"name":"Jing Yuan","is_ca":true},{"name":"Xu Zhang","is_ca":false},{"name":"Ruyi Wang","is_ca":false},{"name":"Mingyan Gu","is_ca":false},{"name":"Shule Zhang","is_ca":false},{"name":"Yafen Chen","is_ca":false},{"name":"Lina Guo","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.004447101696910068,"gpt":0.2209513614372584,"spread":0.2165042597403484,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.00111516,0.0004091174,0.0005895967,0.0002516263,0.0004563706,0.0001875931,0.0005600858,0.000177221,0.00002437186],"category_scores_gemma":[0.000853864,0.0003941153,0.0001247988,0.001297553,0.0003579195,0.0005022801,0.0003301436,0.0001511594,0.0001765245],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003194821,"about_ca_system_score_gemma":0.0001177046,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00006243249,"about_ca_topic_score_gemma":0.000005487663,"domain_scores_codex":[0.9967626,0.00006070007,0.0006105653,0.001165223,0.0006884513,0.0007124758],"domain_scores_gemma":[0.9982088,0.0001093124,0.0004295282,0.0007283638,0.000357459,0.0001665758],"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":[0.00009455859,0.00006188495,0.00006295011,0.0007161439,0.00003695032,0.000005720968,0.00102546,0.0001349984,0.9907198,0.000005429337,0.006943374,0.0001927508],"study_design_scores_gemma":[0.0004241745,0.0002373232,0.00005357721,0.0001829149,0.000134859,0.0000488951,0.0001141118,0.00292332,0.9952962,0.00005550024,0.0001152204,0.0004138393],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9975821,0.0003807606,0.0001163991,0.0002057277,0.0003060476,0.0006756895,0.0004444311,0.0001842601,0.0001045507],"genre_scores_gemma":[0.9970331,0.0000534802,0.0003466779,0.0000770026,0.00006882576,0.0001912045,0.001329547,0.00006487802,0.0008352647],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.006828154,"threshold_uncertainty_score":0.999851,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2976557049","doi":"10.1016/j.mcat.2019.110631","title":"S-glycosyltransferase UGT74B1 can glycosylate both S- and O-acceptors: mechanistic insights through substrate specificity","year":2019,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Genomics, phytochemicals, and oxidative stress","field":"Biochemistry, Genetics and Molecular Biology","cited_by":14,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Laurentian University","funders":"Région Normandie; Centre National de la Recherche Scientifique; Agence Nationale de la Recherche; Indian National Science Academy","keywords":"Glycosylation; Chemistry; Nucleophile; Deprotonation; Sulfur; Catalysis; Enzyme kinetics; Stereochemistry; Substrate (aquarium); Glycosyltransferase; Active site; Combinatorial chemistry; Enzyme; Biochemistry; Organic chemistry; Biology","authors":[{"name":"Pierre Lafite","is_ca":false},{"name":"S. Marroun","is_ca":false},{"name":"Gaël Coadou","is_ca":false},{"name":"Sabine Montaut","is_ca":true},{"name":"Stéphanie Marquès","is_ca":false},{"name":"Marie Schuler","is_ca":false},{"name":"Patrick Rollin","is_ca":false},{"name":"Arnaud Tatibouët","is_ca":false},{"name":"Richard Daniellou","is_ca":false},{"name":"Hassan Oulyadi","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.00563372148968586,"gpt":0.2072415960818209,"spread":0.201607874592135,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.00008960526,0.0004000152,0.0004112442,0.00007223147,0.0001076467,0.00008304747,0.0003274074,0.0002230173,0.0001026352],"category_scores_gemma":[0.00003529606,0.0004010983,0.0002268538,0.0002058776,0.0001384408,0.00001232557,0.0001482408,0.0001688913,0.00004918383],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00003559405,"about_ca_system_score_gemma":0.00006585531,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001698784,"about_ca_topic_score_gemma":0.0001548662,"domain_scores_codex":[0.9979698,0.00008363116,0.0003472746,0.0009313016,0.0002298044,0.0004381677],"domain_scores_gemma":[0.9988035,0.00001376852,0.0001102121,0.0007912254,0.00009856288,0.0001827111],"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":[0.00009874911,0.00008977324,0.0004984602,0.00004722054,0.0002369758,0.00002732466,0.0001812514,0.00005472726,0.9977665,0.000596099,0.00006616968,0.0003367632],"study_design_scores_gemma":[0.0007571291,0.0002209025,0.0004715801,0.00001635329,0.0001266447,0.00001382834,0.0001532173,0.00006630651,0.9912567,0.001312699,0.005077194,0.0005274993],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9882149,0.001440308,0.008134478,0.00009962993,0.0001383965,0.000360999,0.0001033302,0.00002668723,0.001481243],"genre_scores_gemma":[0.9969487,0.0004819238,0.0008211173,0.0003698747,0.0001076635,0.00002751862,0.0008907593,0.00006141664,0.0002910289],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.008733769,"threshold_uncertainty_score":0.9998441,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4384393258","doi":"10.1016/j.mcat.2023.113366","title":"Machine-learning-guided prediction of Cu-based electrocatalysts towards ethylene production in CO2 reduction","year":2023,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"CO2 Reduction Techniques and Catalysts","field":"Energy","cited_by":13,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Ottawa","funders":"Higher Education Discipline Innovation Project; National Natural Science Foundation of China","keywords":"Ethylene; Catalysis; Copper; Electrolyte; Selectivity; Reduction (mathematics); Materials science; Carbon black; Ethylene glycol; Chemical engineering; Chemistry; Electrode; Metallurgy; Organic chemistry; Composite material; Mathematics; Engineering","authors":[{"name":"Qing Zhang","is_ca":true},{"name":"Kai Zhu","is_ca":true},{"name":"Yuhong Luo","is_ca":false},{"name":"Zhengyu Bai","is_ca":false},{"name":"Zisheng Zhang","is_ca":true},{"name":"Jingde Li","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.0134995986283931,"gpt":0.2498040775420924,"spread":0.2363044789136993,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0007586032,0.0002907466,0.0004376079,0.001296656,0.0001071748,0.00002626423,0.0002439068,0.0002225726,0.00007042175],"category_scores_gemma":[0.0002779276,0.0003173082,0.0003223364,0.004042275,0.00009063089,0.0001844687,0.00007246464,0.0003586266,0.00005538234],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002740971,"about_ca_system_score_gemma":0.0001211607,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.004628285,"about_ca_topic_score_gemma":0.0001837855,"domain_scores_codex":[0.9973213,0.0002186941,0.0007228609,0.0007140063,0.0006117395,0.0004114005],"domain_scores_gemma":[0.9986253,0.00001329849,0.0002989704,0.0007331095,0.0002383541,0.00009093347],"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":[0.0000811286,0.0001812801,0.0006308475,0.0001072309,0.0001428528,0.00002541546,0.0003090777,0.0518659,0.9259067,0.0002398952,0.0006150436,0.01989461],"study_design_scores_gemma":[0.0004503468,0.0001323241,0.001341795,0.00004719074,0.0001594896,0.00003828676,0.0001197935,0.00883688,0.9854807,0.000447365,0.00269321,0.0002526013],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9946157,0.0003919425,0.001509142,0.0008177134,0.0003368063,0.0003934573,0.00001750064,0.0008694177,0.001048365],"genre_scores_gemma":[0.9953644,0.0001963186,0.0002600289,0.00001760597,0.00009966091,0.0002123578,0.002780027,0.00006991321,0.0009996834],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.05957399,"threshold_uncertainty_score":0.9999279,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4392671431","doi":"10.1016/j.mcat.2024.114013","title":"Effect of loading method on catalytic performance of Pt/CeO2 system for CO oxidation","year":2024,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Catalytic Processes in Materials Science","field":"Materials Science","cited_by":12,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Toronto","funders":"University of Jinan","keywords":"Catalysis; Calcination; Noble metal; Sintering; Oxygen; Chemical engineering; Materials science; Nanoparticle; Deposition (geology); Metal; Inorganic chemistry; Chemistry; Nanotechnology; Metallurgy; Organic chemistry","authors":[{"name":"Jianyi Fan","is_ca":false},{"name":"Shanhong Hu","is_ca":false},{"name":"Chunsheng Li","is_ca":false},{"name":"Yong Wang","is_ca":true},{"name":"Guozhu Chen","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.007035703035509102,"gpt":0.2980392005272879,"spread":0.2910034974917788,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.003033217,0.0002231244,0.0005421782,0.0003157998,0.00007499351,0.00011126,0.0005530986,0.00007920558,0.00002647808],"category_scores_gemma":[0.0004011443,0.000185358,0.0002010395,0.0006730028,0.0001413536,0.0002622084,0.0000938709,0.00005680388,0.0000965252],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001548564,"about_ca_system_score_gemma":0.00009684633,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00003909724,"about_ca_topic_score_gemma":7.002208e-7,"domain_scores_codex":[0.9979093,0.0001224979,0.0005575246,0.0005652349,0.0005551339,0.0002903287],"domain_scores_gemma":[0.9984065,0.0005120669,0.000248365,0.000642499,0.0001278068,0.00006272066],"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":[0.0001117972,0.00001691467,0.00001484807,0.005250341,0.0000350818,0.000007543397,0.0001426618,0.001350879,0.990401,0.0006022998,0.00002756342,0.002039055],"study_design_scores_gemma":[0.0002079308,0.0004461403,0.000006917,0.0004903257,0.0002954489,0.00002217725,0.00002477251,0.01736484,0.9809024,0.00001622499,0.00005801641,0.0001648002],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9278908,0.00022943,0.07049087,0.00001780888,0.0004355313,0.0004341296,0.00009101532,0.0001004569,0.0003099911],"genre_scores_gemma":[0.9964596,0.000003435486,0.003220646,0.000009273601,0.00003493244,0.0001076617,0.00009100173,0.00003184702,0.00004160061],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.06856883,"threshold_uncertainty_score":0.7558681,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2977613136","doi":"10.1016/j.mcat.2019.110647","title":"Mechanistic insights into the origin of substituent-directed product Z–E selectivity for gold-catalyzed [4+1]-annulations of 1,4-diyn-3-ols with isoxazoles: A DFT study","year":2019,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Catalytic Alkyne Reactions","field":"Chemistry","cited_by":11,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Waterloo","funders":"Natural Science Foundation of Shandong Province; China Postdoctoral Science Foundation; National Natural Science Foundation of China","keywords":"Chemistry; Chemoselectivity; Isoxazole; Substituent; Nucleophile; Isomerization; Enone; Selectivity; Stereochemistry; Catalysis; Double bond; Medicinal chemistry; Organic chemistry","authors":[{"name":"Kaifeng Wang","is_ca":false},{"name":"Yuxia Liu","is_ca":true},{"name":"Qiao Wu","is_ca":false},{"name":"Lingjun Liu","is_ca":false},{"name":"Yulin Li","is_ca":false},{"name":"Tony D. James","is_ca":false},{"name":"Guang Chen","is_ca":false},{"name":"Siwei Bi","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.009232748646500316,"gpt":0.2445372870876745,"spread":0.2353045384411742,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0002658169,0.0003496353,0.0007022236,0.0002425404,0.0001331966,0.00003357611,0.0004999245,0.00009188779,0.00006984337],"category_scores_gemma":[0.0003399509,0.0002652493,0.000303903,0.001408803,0.0001547706,0.0001567825,0.0001149069,0.0002133519,0.00001731129],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001913666,"about_ca_system_score_gemma":0.000307415,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001636873,"about_ca_topic_score_gemma":0.001358452,"domain_scores_codex":[0.997704,0.0000581177,0.0006018638,0.0007206367,0.0006109292,0.0003044472],"domain_scores_gemma":[0.9967109,0.0002741536,0.0005174159,0.001760986,0.0006517412,0.00008481503],"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":[0.0001921383,0.001197385,0.00386503,0.0003181844,0.001851803,0.000007229091,0.004001824,0.0009232646,0.9866625,0.0005894733,0.00003202715,0.0003591564],"study_design_scores_gemma":[0.001797926,0.0001239838,0.001355777,0.00008092161,0.002424242,0.00001432729,0.001996742,0.002883231,0.9879818,0.0003624609,0.0005355303,0.0004430731],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9929472,0.0002350675,0.004642775,0.00007006752,0.00006879555,0.001353674,0.00005864266,0.0001130175,0.000510801],"genre_scores_gemma":[0.9978313,0.000004738507,0.0005385111,0.000006038115,0.00003252314,0.0003792841,0.0004586794,0.00006609346,0.0006828613],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004884112,"threshold_uncertainty_score":0.99998,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4379203783","doi":"10.1016/j.mcat.2023.113272","title":"Theoretical study of CO2 electrochemical reduction on Cu(111) and Sn@Cu(111) surface in presence of water","year":2023,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"CO2 Reduction Techniques and Catalysts","field":"Energy","cited_by":9,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Ottawa","funders":"Colleges and Universities in Hebei Province Science and Technology Research Project; Natural Science Foundation of Hebei Province; National Natural Science Foundation of China","keywords":"Electrochemistry; Reduction (mathematics); Copper; Catalysis; Surface (topology); Chemistry; Inorganic chemistry; Chemical engineering; Materials science; Metallurgy; Electrode; Physical chemistry; Mathematics; Geometry; Engineering; Organic chemistry","authors":[{"name":"Ruirui Ma","is_ca":false},{"name":"Shuai Li","is_ca":false},{"name":"Shujuan Sun","is_ca":false},{"name":"Yuhong Luo","is_ca":false},{"name":"Yaqi Mao","is_ca":false},{"name":"Jingde Li","is_ca":false},{"name":"Zisheng Zhang","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.006184762695947331,"gpt":0.2425303273042213,"spread":0.2363455646082739,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0003324085,0.0001703188,0.0003641378,0.0002537373,0.00003213116,0.00001260978,0.0001889276,0.0001130133,0.00008759915],"category_scores_gemma":[0.00005965398,0.0001432621,0.0001108296,0.0007944481,0.0001825553,0.00005271504,0.0001413462,0.0001738907,0.00001200951],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00004376989,"about_ca_system_score_gemma":0.00001431593,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001012556,"about_ca_topic_score_gemma":0.00005723959,"domain_scores_codex":[0.9983763,0.0001294557,0.0004086909,0.000435573,0.0003766915,0.0002733574],"domain_scores_gemma":[0.9991965,0.00003526942,0.00007651647,0.0005454026,0.0000836824,0.00006262076],"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":[0.0001843621,0.0003781817,0.000204065,0.00003265126,0.0001004243,0.0000206817,0.001071437,0.0007556912,0.9909829,0.005116726,0.00005809275,0.001094708],"study_design_scores_gemma":[0.0003742585,0.0004182228,0.0002729369,0.00002162348,0.00009594989,0.00001193126,0.0008151904,0.0007739504,0.9944235,0.002595028,0.00004384397,0.0001535608],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.998666,0.00006984937,0.0001168047,0.0001940563,0.00003549383,0.000232501,0.000002701243,0.00007829729,0.0006042319],"genre_scores_gemma":[0.999588,0.00004841727,0.00006111609,0.000007523043,0.00001536082,0.00003563352,0.00009438716,0.00002662404,0.0001229917],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003440524,"threshold_uncertainty_score":0.5842059,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3137251477","doi":"10.1016/j.mcat.2021.111526","title":"Hydrodeoxygenation of oleic acid using γ-Al2O3 supported transition metallic catalyst systems: Insight into the development of novel FeCu/γ-Al2O3 catalyst","year":2021,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Catalysis and Hydrodesulfurization Studies","field":"Engineering","cited_by":9,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"Canadian Light Source (Canada); University of Saskatchewan","funders":"Canada Excellence Research Chairs, Government of Canada; Natural Sciences and Engineering Research Council of Canada; Canada Research Chairs; BioFuelNet Canada","keywords":"Hydrodeoxygenation; Catalysis; Oleic acid; Hydrodesulfurization; Bimetallic strip; Mesoporous material; Transition metal; Selectivity; Materials science; Metal; Chemistry; Chemical engineering; Nuclear chemistry; Organic chemistry","authors":[{"name":"Naveenji Arun","is_ca":true},{"name":"Sonil Nanda","is_ca":true},{"name":"Yongfeng Hu","is_ca":true},{"name":"Ajay K. Dalai","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.0168165433482946,"gpt":0.2245671446759435,"spread":0.2077506013276489,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0004877644,0.00038745,0.0008588387,0.0004670925,0.0002234995,0.00006224935,0.0003095735,0.000145715,0.00002549702],"category_scores_gemma":[0.00006077078,0.0003485082,0.0004137516,0.00191071,0.0001221086,0.0002395811,0.0001193033,0.0001541076,0.00001092017],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002030793,"about_ca_system_score_gemma":0.0001739876,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00024643,"about_ca_topic_score_gemma":0.0005042806,"domain_scores_codex":[0.9970417,0.00008274609,0.001323461,0.0004732249,0.0007653584,0.0003135283],"domain_scores_gemma":[0.9981226,0.00004183592,0.0003346369,0.0008497127,0.0005619978,0.0000891639],"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":[0.000005846309,0.0001364941,0.00002073116,0.0003473203,0.001855341,0.00001173408,0.009204715,0.09413256,0.8936335,0.0001201152,0.000007560603,0.0005240347],"study_design_scores_gemma":[0.0004997563,0.000008196153,0.0001647137,0.00008414545,0.001138538,0.00001969064,0.001353503,0.07096188,0.9247619,0.000007517972,0.0006413818,0.0003587657],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.7534382,0.005127484,0.2406046,0.00005829656,0.0001317048,0.0002468054,0.00005795132,0.00007524445,0.0002596485],"genre_scores_gemma":[0.9950833,0.00008533728,0.002460358,0.00001967594,0.00003060348,0.00006080199,0.002156082,0.00006937255,0.00003451202],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.241645,"threshold_uncertainty_score":0.9998967,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4388194686","doi":"10.1016/j.mcat.2023.113554","title":"Integrating dehydrogenation of alkanes with selective hydrogen combustion – A sustainable route for olefin production using tandem catalysis","year":2023,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Catalysis and Oxidation Reactions","field":"Chemical Engineering","cited_by":8,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Western University","funders":"King Fahd University of Petroleum and Minerals","keywords":"Dehydrogenation; Catalysis; Tandem; Olefin fiber; Chemistry; Commodity chemicals; Environmentally friendly; Redox; Combinatorial chemistry; Organic chemistry; Chemical engineering; Materials science","authors":[{"name":"Yahya Gambo","is_ca":false},{"name":"Rahima A. Lucky","is_ca":true},{"name":"Mohammed S. Ba‐Shammakh","is_ca":false},{"name":"Mohammad M. Hossain","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01044554149859728,"gpt":0.2410291563357998,"spread":0.2305836148372025,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000369833,0.0002219678,0.0003779322,0.0005997657,0.0002174891,0.00003840073,0.00013357,0.0001047784,0.000009998584],"category_scores_gemma":[0.0004477156,0.0002123046,0.0002685,0.003007922,0.0000455022,0.0002911272,0.00005053599,0.0001209692,0.00000603637],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003180011,"about_ca_system_score_gemma":0.00008341598,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006485165,"about_ca_topic_score_gemma":0.0001157124,"domain_scores_codex":[0.9983726,0.00003256819,0.0004212967,0.0004707904,0.0003631104,0.0003396581],"domain_scores_gemma":[0.9985901,0.000066418,0.0002882647,0.0003786518,0.0006084308,0.00006812626],"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":[0.00002249709,0.00005778268,0.0003234731,0.00007983308,0.000518584,0.000006076202,0.000380041,0.2152216,0.7821217,0.0005631748,0.00002124786,0.0006840267],"study_design_scores_gemma":[0.0002893151,0.000033354,0.00009576935,0.00003217382,0.0008222059,0.00001206168,0.001091347,0.1824607,0.8147058,0.0001138224,0.0001250832,0.00021836],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8562099,0.00004492372,0.1429118,0.0001149326,0.00002454165,0.0004110277,0.00001717505,0.0001652856,0.0001003297],"genre_scores_gemma":[0.9951385,0.000007029977,0.00217062,0.00001000977,0.00004539742,0.0001775361,0.001978618,0.00005272404,0.0004195918],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.1407412,"threshold_uncertainty_score":0.8657529,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4385470863","doi":"10.1016/j.mcat.2023.113420","title":"Zr-MOF catalyzed selective oxidation of anilines to azoxybenzenes in aqueous H2O2 solution","year":2023,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Metal-Organic Frameworks: Synthesis and Applications","field":"Chemistry","cited_by":6,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Waterloo","funders":"Zhejiang Xinmiao Talents Program; National Natural Science Foundation of China","keywords":"Catalysis; Hydrogen peroxide; Aqueous solution; Chemistry; Solvent; Metal-organic framework; Yield (engineering); Linker; Heterogeneous catalysis; Zirconium; Combinatorial chemistry; Chemical engineering; Organic chemistry; Materials science; Adsorption","authors":[{"name":"Jianhong Zheng","is_ca":false},{"name":"Xi Chen","is_ca":true},{"name":"Xiaoxiao Yin","is_ca":true},{"name":"Kai Chen","is_ca":false},{"name":"Aili Liu","is_ca":true},{"name":"Xiaochun Yu","is_ca":false},{"name":"Shun Wang","is_ca":false},{"name":"Zhongwei Chen","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01106765915732677,"gpt":0.2492070776935469,"spread":0.2381394185362201,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002343122,0.0001821923,0.000342585,0.000304333,0.00006716739,0.00002352757,0.0002691387,0.0001676381,0.0001588825],"category_scores_gemma":[0.0005602612,0.0001943507,0.0001600873,0.00200631,0.00003368759,0.00006671515,0.0001041827,0.0001252902,0.0001557648],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00009525383,"about_ca_system_score_gemma":0.00005132906,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005306706,"about_ca_topic_score_gemma":0.0002514279,"domain_scores_codex":[0.9985104,0.0000345554,0.0004388808,0.0004495716,0.0002936893,0.0002729699],"domain_scores_gemma":[0.9988682,0.00009154939,0.0001532158,0.0006311293,0.000174083,0.00008183087],"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":[0.00001316188,0.00009006376,0.0003251791,0.0000473009,0.00008203959,0.00000722832,0.0003110539,0.0005520754,0.9899196,0.0001558672,0.0002408375,0.008255615],"study_design_scores_gemma":[0.0001593177,0.000006591159,0.0008458013,0.00004265111,0.0001032454,0.000002411275,0.0002127143,0.001920418,0.9956776,0.0003907213,0.0004451007,0.0001933965],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9906902,0.0002235733,0.007471295,0.0006835143,0.00002274008,0.0001483294,0.00003254498,0.0001076698,0.0006200975],"genre_scores_gemma":[0.9979047,0.00004030683,0.0009749673,0.0000486545,0.00003622176,0.0001641018,0.0005202012,0.00003618718,0.000274698],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.008062218,"threshold_uncertainty_score":0.7925391,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4391032434","doi":"10.1016/j.mcat.2024.113856","title":"Experimental and computational study on removal of nitric oxide using NH2-MIL-125: Revisiting removal mechanism","year":2024,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Gas Sensing Nanomaterials and Sensors","field":"Engineering","cited_by":6,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Waterloo","funders":"China University of Mining and Technology; National Natural Science Foundation of China","keywords":"Nitric oxide; Mechanism (biology); Chemistry; Catalysis; Oxide; Environmental chemistry; Chemical engineering; Organic chemistry; Engineering; Philosophy; Epistemology","authors":[{"name":"Jiayou Liu","is_ca":false},{"name":"Xiaoxiang Huang","is_ca":false},{"name":"Zhongchao Tan","is_ca":true},{"name":"Hesheng Yu","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01347946088279584,"gpt":0.2424736121654858,"spread":0.22899415128269,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001833685,0.0001871217,0.0002941789,0.0002696438,0.0000585444,0.00008432441,0.00006281053,0.00005182658,0.000008604625],"category_scores_gemma":[0.00001865349,0.000193867,0.0001024586,0.0003343045,0.00002205426,0.00005604805,0.00004466145,0.00007693341,0.000007393732],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00007196284,"about_ca_system_score_gemma":0.00001181122,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00005144166,"about_ca_topic_score_gemma":2.27027e-7,"domain_scores_codex":[0.9988943,0.00005865464,0.0003176411,0.0002787792,0.0002778489,0.0001727269],"domain_scores_gemma":[0.9996635,0.00003790609,0.00003536301,0.0001806955,0.00003008594,0.00005241094],"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":[0.00000685814,0.00002872487,0.00000890284,0.00005871329,0.0001855113,0.001517172,0.0003293226,0.0394853,0.9575827,0.0003108811,0.000003210679,0.0004826659],"study_design_scores_gemma":[0.0003290789,0.00005771018,0.00030294,0.000142472,0.0002333515,0.0006618088,0.0007065989,0.3283311,0.668723,0.0001866736,0.00003482737,0.000290384],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9907566,0.001216635,0.007468443,0.000008281238,0.0000986832,0.0001526032,0.000009991742,0.0001389618,0.0001497467],"genre_scores_gemma":[0.9917334,0.000002901548,0.008120031,0.00001291711,0.00004222947,0.000001756781,0.00002388529,0.00005202959,0.00001088137],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.2888597,"threshold_uncertainty_score":0.7905668,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4408988121","doi":"10.1016/j.mcat.2025.115057","title":"A comprehensive insight into the role of synthesis methods on the properties and performance of bio-derived heterogeneous catalysts for biodiesel production","year":2025,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Biodiesel Production and Applications","field":"Engineering","cited_by":6,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Alberta","funders":"","keywords":"Catalysis; Biodiesel production; Biodiesel; Production (economics); Biochemical engineering; Chemistry; Pulp and paper industry; Engineering; Organic chemistry; Economics","authors":[{"name":"Andrew Nosakhare Amenaghawon","is_ca":false},{"name":"Ubani Oluwaseun Amune","is_ca":false},{"name":"Joshua Efosa Ayere","is_ca":false},{"name":"Ifechukwude Christopher Otuya","is_ca":false},{"name":"Stanley Aimhanesi Eshiemogie","is_ca":false},{"name":"Esther Imhande Ehiawaguan","is_ca":false},{"name":"Gabriel Diemesor","is_ca":false},{"name":"Emmanuel Christopher Abuga","is_ca":false},{"name":"Osamudiamhen Oiwoh","is_ca":false},{"name":"Olusola Tijani","is_ca":false},{"name":"Peter Kayode Oyefolu","is_ca":false},{"name":"Oseweuba Valentine Okoro","is_ca":false},{"name":"Amin Shavandi","is_ca":false},{"name":"Chinedu L. Anyalewechi","is_ca":false},{"name":"Ehiaghe Agbovhimen Elimian","is_ca":true},{"name":"Maxwell Ogaga Okedi","is_ca":false},{"name":"Ibhadebhunuele Gabriel Okoduwa","is_ca":false},{"name":"Steve Oshiokhai Eshiemogie","is_ca":false},{"name":"Osarieme Osazuwa","is_ca":false},{"name":"Handoko Darmokoesoemo","is_ca":false},{"name":"Heri Septya Kusuma","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01856930665982013,"gpt":0.2368036069875364,"spread":0.2182343003277163,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001571185,0.0001230978,0.0001977486,0.0001144215,0.0001542281,0.00001356294,0.0001584853,0.00004225638,0.00000115102],"category_scores_gemma":[0.0001058181,0.00007440874,0.00008810683,0.0003933182,0.0002279668,0.00003087581,0.00004637081,0.00006538261,0.000001212822],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00001960036,"about_ca_system_score_gemma":0.00001229278,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00004243618,"about_ca_topic_score_gemma":0.000006011742,"domain_scores_codex":[0.9993557,0.00005942835,0.000215073,0.0001917483,0.00008256721,0.00009546916],"domain_scores_gemma":[0.9992176,0.00008096232,0.00005783446,0.0004831025,0.0001463764,0.00001418348],"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":[0.00002804329,0.00002671824,0.00003693348,0.0002369139,0.0003684514,4.111067e-8,0.001497919,0.002470328,0.9552577,0.0001628795,0.00005086724,0.03986328],"study_design_scores_gemma":[0.00003972019,0.00002055038,0.0001169423,0.0000327502,0.0001583762,0.00000131923,0.0004400376,0.007578994,0.986423,0.00009072927,0.005024318,0.00007323459],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9897362,0.006162319,0.001860654,0.001412341,0.00005741183,0.0005632304,0.000008262976,0.00004290213,0.0001566948],"genre_scores_gemma":[0.9976927,0.0002717081,0.001499708,0.00003849842,0.00001018335,0.0004463175,0.000008364275,0.00001141667,0.00002108327],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.03979004,"threshold_uncertainty_score":0.3034301,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W2791744095","doi":"10.1016/j.mcat.2018.02.012","title":"Mechanistic kinetics and reactor modelling of hydrogen production from the partial oxidation of diesel over a quartenary metal oxide catalyst","year":2018,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Catalytic Processes in Materials Science","field":"Materials Science","cited_by":5,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Regina","funders":"Natural Sciences and Engineering Research Council of Canada; Canada Foundation for Innovation; Faculty of Graduate Studies and Research, University of Regina","keywords":"Catalysis; Isothermal process; Chemistry; Diesel fuel; Partial oxidation; Partial pressure; Plug flow; Kinetics; Thermodynamics; Plug flow reactor model; Oxide; Hydrogen; Hexadecane; Rate equation; Chemical engineering; Physical chemistry; Continuous stirred-tank reactor; Organic chemistry; Oxygen","authors":[{"name":"Ishioma Judith Oluku","is_ca":true},{"name":"Faysal Khan","is_ca":true},{"name":"Raphael Idem","is_ca":true},{"name":"Hussameldin Ibrahim","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.0173442691178981,"gpt":0.2325757505451454,"spread":0.2152314814272473,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0006516775,0.0001730867,0.000335037,0.0000745477,0.00009171719,0.00004328795,0.0004233553,0.00006301775,0.00005602293],"category_scores_gemma":[0.0004225445,0.0001330543,0.00007783192,0.0003931204,0.0006030959,0.0002454197,0.0002210864,0.00004731254,0.00001644672],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00003309531,"about_ca_system_score_gemma":0.00005249538,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001369003,"about_ca_topic_score_gemma":0.0000654617,"domain_scores_codex":[0.9981411,0.00008640899,0.0005072826,0.0005057848,0.0005414902,0.0002179349],"domain_scores_gemma":[0.9984566,0.00007836691,0.0004163111,0.0007554423,0.0002366956,0.00005660479],"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":[0.00004608779,0.00005759355,0.00002762108,0.00003600721,0.0000422484,0.000002440579,0.000615331,0.0005609038,0.9983771,0.0001516787,0.00000869492,0.00007426618],"study_design_scores_gemma":[0.0001144663,0.00007068418,0.00006313099,0.00003210377,0.0003678924,0.00000796153,0.0001204921,0.006778324,0.9906291,0.001657157,0.00001919481,0.0001394428],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9390046,0.0002423404,0.06016613,0.00008199373,0.0001913425,0.0001881435,0.00008365098,0.00002426813,0.00001751132],"genre_scores_gemma":[0.9966576,0.00001374335,0.00307236,0.00002357577,0.00009320554,0.00001920247,0.00009338531,0.00001785452,0.000009086433],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.05765297,"threshold_uncertainty_score":0.5425798,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4410707845","doi":"10.1016/j.mcat.2025.115220","title":"Challenges and opportunities to design a highly active hydrodesulfurization catalyst: A comprehensive review","year":2025,"lang":"en","type":"review","venue":"Molecular Catalysis","topic":"Catalysis and Hydrodesulfurization Studies","field":"Engineering","cited_by":5,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Polytechnique Montréal","funders":"","keywords":"Hydrodesulfurization; Catalysis; Chemistry; Organic chemistry","authors":[{"name":"Shalini Arora","is_ca":false},{"name":"Rupesh Kumar Singh","is_ca":false},{"name":"Rashmi Khan","is_ca":true},{"name":"Deepak Kunzru","is_ca":false},{"name":"Sri Sivakumar","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.09327216640983134,"gpt":0.3007102612839431,"spread":0.2074380948741117,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0002421936,0.0009146963,0.003341022,0.001042205,0.0001320821,0.0000774894,0.0003875475,0.0002613098,0.0000101028],"category_scores_gemma":[0.0001230705,0.0008778488,0.0006638737,0.000883608,0.0000772354,0.000144394,0.0003168237,0.0002652319,0.00005939081],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001847826,"about_ca_system_score_gemma":0.0001383543,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00000730442,"about_ca_topic_score_gemma":0.00001129752,"domain_scores_codex":[0.9970837,0.000253073,0.0009654373,0.0008821464,0.0004048202,0.0004108107],"domain_scores_gemma":[0.9980472,0.000252416,0.0002305313,0.001011298,0.0002400744,0.0002185238],"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":[0.000002112539,0.00001982473,5.484172e-9,0.07311404,0.002063,0.00005695269,0.000232925,0.0003682784,0.00001407126,0.0001160432,0.001282083,0.9227307],"study_design_scores_gemma":[0.0001100764,0.00002490537,5.090982e-7,0.03267755,0.00831171,0.00002832912,0.00006014942,0.0000911937,0.0001439191,0.00002093858,0.957635,0.0008957175],"study_design_candidate":"not_applicable","study_design_consensus":null,"genre_codex":"review","genre_gemma":"review","genre_scores_codex":[9.633741e-7,0.9872351,0.008642248,0.0002278522,0.0001111536,0.00157406,0.0001823453,0.0003030999,0.001723188],"genre_scores_gemma":[0.00003015194,0.9961499,0.0003076925,0.0003114939,0.00004324771,0.0010577,0.001664898,0.0001271153,0.0003077962],"genre_candidate":"review","genre_consensus":"review","teacher_disagreement_score":0.9563529,"threshold_uncertainty_score":0.9993672,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4399723803","doi":"10.1016/j.mcat.2024.114277","title":"Facile synthesis of Ni-M/MgO (M=Y2O3, Gd2O3) catalysts using the surfactant-assisted co-precipitation method and their applications in the methane decomposition reaction","year":2024,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Catalytic Processes in Materials Science","field":"Materials Science","cited_by":5,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Calgary","funders":"University of Kashan","keywords":"Catalysis; Methane; Decomposition; Pulmonary surfactant; Precipitation; Coprecipitation; Chemistry; Thermal decomposition; Inorganic chemistry; Chemical engineering; Nuclear chemistry; Organic chemistry","authors":[{"name":"Hossein Mansooripour","is_ca":false},{"name":"Fatemeh Bibak","is_ca":false},{"name":"Fereshteh Meshkani","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01939194516062586,"gpt":0.3293987065534187,"spread":0.3100067613927929,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.002888441,0.0002218098,0.0003348166,0.0002483051,0.0002056061,0.000270059,0.0005907906,0.0000880614,0.00002028847],"category_scores_gemma":[0.0002946437,0.0001362027,0.0001126989,0.001256268,0.0002608358,0.0003926645,0.0001059097,0.0001209672,0.00001634758],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001262577,"about_ca_system_score_gemma":0.0001052185,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0009849648,"about_ca_topic_score_gemma":0.00009415081,"domain_scores_codex":[0.9977471,0.0004849811,0.0005098289,0.0005554125,0.0004479923,0.000254648],"domain_scores_gemma":[0.9979312,0.0009722632,0.0002247979,0.000718332,0.0001097474,0.00004362723],"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":[0.00001174008,0.00004258252,0.00001674085,0.0001184427,0.00003143044,0.000004980985,0.001695969,0.0002593575,0.9936879,0.0002305923,0.000009033094,0.003891191],"study_design_scores_gemma":[0.00006113593,0.00001339181,0.0004822579,0.00006649173,0.000234553,0.00008684781,0.001287725,0.004230006,0.9921073,0.001177481,0.00009311922,0.0001597361],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8258923,0.0007321397,0.1721966,0.0002885665,0.0001179169,0.0004458004,0.0001609306,0.00005146573,0.0001142885],"genre_scores_gemma":[0.9952628,0.00002616073,0.004288368,0.00003850777,0.00002221735,0.0001948516,0.00013952,0.00002023634,0.000007325966],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.1693705,"threshold_uncertainty_score":0.5554186,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4205959999","doi":"10.1016/j.mcat.2022.112137","title":"Polyphenylene sulfide as an efficient solid-phase ligand for improved selective alkyne hydrogenation","year":2022,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Asymmetric Hydrogenation and Catalysis","field":"Chemistry","cited_by":5,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Concordia University; Laurentian University","funders":"","keywords":"Nanomaterial-based catalyst; Alkyne; Catalysis; Combinatorial chemistry; Sulfide; Chemistry; Ligand (biochemistry); Selectivity; Isomerization; Materials science; Organic chemistry; Chemical engineering","authors":[{"name":"Lingqi Huang","is_ca":false},{"name":"Ganggang Ye","is_ca":false},{"name":"Zhibin Ye","is_ca":true}],"retraction":null,"screen_n_in":null,"score":{"opus":0.00677266377771554,"gpt":0.2839004516729464,"spread":0.2771277878952309,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0004373172,0.0003134549,0.0004096982,0.0004767288,0.0006201103,0.00007876303,0.0004812799,0.0001082898,0.0005051467],"category_scores_gemma":[0.0002547936,0.0003603167,0.0004928166,0.001616836,0.00004727275,0.00009683015,0.000193074,0.0002236646,0.00002479332],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004681512,"about_ca_system_score_gemma":0.0001780939,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001986239,"about_ca_topic_score_gemma":0.00001767766,"domain_scores_codex":[0.997519,0.00006335053,0.0004929883,0.0008299494,0.0006148071,0.0004798842],"domain_scores_gemma":[0.9983627,0.00006842206,0.0003041414,0.0007633177,0.0002424014,0.0002589685],"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":[0.0002401443,0.001106274,0.000008897305,0.00002204736,0.0007175148,0.0000296391,0.0006383103,0.006183027,0.9773747,0.0002544408,0.0001210858,0.01330394],"study_design_scores_gemma":[0.002176867,0.0001661345,0.000001810631,0.000001937015,0.0005631376,0.00002680411,0.0005029919,0.1155267,0.8756338,0.0002622276,0.004744609,0.0003929564],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9667266,0.0004635278,0.02962141,0.0003274391,0.00006189063,0.0003337583,0.0003525117,0.0001823045,0.001930531],"genre_scores_gemma":[0.9925145,0.000005398173,0.0004424903,0.0004627209,0.00006468956,0.0006319851,0.004669924,0.00008006224,0.001128259],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.1093436,"threshold_uncertainty_score":0.9998849,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W3042164810","doi":"10.1016/j.mcat.2020.111084","title":"Oxidative cyclization of linoleic acid in the presence of hydrogen peroxide and phosphotungstic acid","year":2020,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Chemical Synthesis and Reactions","field":"Chemistry","cited_by":3,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"McGill University; Centre in Green Chemistry and Catalysis","funders":"European Regional Development Fund; Ministère de l'Education Nationale, de l'Enseignement Superieur et de la Recherche; Ministère de l'Éducation Nationale","keywords":"Phosphotungstic acid; Hydrogen peroxide; Chemistry; Yield (engineering); Catalysis; Linoleic acid; Organic chemistry; Antimicrobial; Peroxide; Oxidative phosphorylation; Fatty acid; Biochemistry; Materials science","authors":[{"name":"Nahla Araji","is_ca":false},{"name":"Grégory Châtel","is_ca":false},{"name":"Audrey Moores","is_ca":true},{"name":"François Jérôme","is_ca":false},{"name":"Karine De Oliveira Vigier","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.009800798759921722,"gpt":0.2147169992285478,"spread":0.2049162004686261,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00005615527,0.00008643428,0.0001867869,0.00002250427,0.00002031795,0.000007026092,0.0001766662,0.00006199764,0.00006571268],"category_scores_gemma":[0.0003277748,0.00006535274,0.00009148389,0.0002958346,0.00008796229,0.00003594481,0.00005688782,0.00009107491,0.000001924587],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00001152521,"about_ca_system_score_gemma":0.00001332905,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00009651914,"about_ca_topic_score_gemma":0.000008281057,"domain_scores_codex":[0.9993046,0.00002152497,0.0002193936,0.0001836365,0.0001819822,0.00008886347],"domain_scores_gemma":[0.9995256,0.00006884763,0.0001153096,0.0002172847,0.00003274245,0.00004022353],"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":[0.00001126216,0.00005674097,0.0009329697,0.00007070757,0.00006082239,0.000005102648,0.001057723,0.00004635025,0.9969112,0.0000264861,0.000005967065,0.0008147117],"study_design_scores_gemma":[0.0001205276,0.000007092111,0.0002491573,0.00002725625,0.000123783,0.000001895114,0.0004065607,0.0006268753,0.9982603,0.00005679435,0.00005423677,0.00006548203],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9973047,0.0009037784,0.0006067083,0.0004184926,0.000002364091,0.00004566121,0.00001693879,0.000007530086,0.0006938312],"genre_scores_gemma":[0.9996833,0.00007039397,0.000108061,0.00005911597,0.00000805435,0.00001228157,0.00004354457,0.000008057393,0.000007231798],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002378564,"threshold_uncertainty_score":0.2665007,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4391730878","doi":"10.1016/j.mcat.2024.113907","title":"Co Implanted <mml:math xmlns:mml=\"http://www.w3.org/1998/Math/MathML\" altimg=\"si14.svg\"> <mml:mstyle mathvariant=\"normal\"> <mml:mi>Ψ</mml:mi> </mml:mstyle> </mml:math> -graphene: A Non-Noble Metal Single-Atom Catalyst for Proficient CO Oxidation Reaction","year":2024,"lang":"lv","type":"article","venue":"Molecular Catalysis","topic":"Electrocatalysts for Energy Conversion","field":"Energy","cited_by":2,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"","funders":"Interdyscyplinarne Centrum Modelowania Matematycznego i Komputerowego UW; Institut de Cardiologie de Montréal; Uniwersytet Warszawski","keywords":"Catalysis; Graphene; Noble metal; Reactivity (psychology); Density functional theory; Exothermic reaction; Materials science; Computational chemistry; Physical chemistry; Chemistry; Physics; Thermodynamics; Nanotechnology; Organic chemistry","authors":[{"name":"Hemang P. Tanna","is_ca":false},{"name":"Bhumi A. Baraiya","is_ca":false},{"name":"Prafulla K. Jha","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01025139956209548,"gpt":0.2289245891305552,"spread":0.2186731895684597,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow","research_integrity","insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.001596561,0.001008985,0.0006614401,0.001055926,0.001125737,0.0009581717,0.001105664,0.001325236,0.0003319306],"category_scores_gemma":[0.0003229461,0.001372996,0.00197798,0.002141656,0.0004625429,0.001242918,0.0004627678,0.0008856063,0.002082082],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002208137,"about_ca_system_score_gemma":0.0009088315,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.004519777,"about_ca_topic_score_gemma":0.001026058,"domain_scores_codex":[0.992467,0.0002455848,0.001564621,0.002014404,0.001974444,0.001733873],"domain_scores_gemma":[0.9955395,0.0003506411,0.001104066,0.002132378,0.0003141606,0.0005592402],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"theoretical_or_conceptual","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0005101601,0.0003976619,0.000004060524,0.0009191806,0.003102276,0.000842997,0.0009296974,0.001522645,0.4647636,0.5224419,0.002705485,0.001860333],"study_design_scores_gemma":[0.0009915084,0.0006605904,0.000009386245,0.0004156145,0.003630156,0.0007202234,0.0006805116,0.2604546,0.7191277,0.0001174735,0.01223673,0.0009555085],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9767653,0.001557624,0.0125234,0.0003518455,0.001309696,0.0002431757,0.0003193539,0.0004888639,0.006440684],"genre_scores_gemma":[0.9793091,0.0002812789,0.001289352,0.0003632517,0.000483419,0.000913245,0.01633066,0.0005328828,0.0004967466],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.5223244,"threshold_uncertainty_score":0.9999713,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4415901326","doi":"10.1016/j.mcat.2025.115561","title":"Green photooxidative degradation of reactive blue dye via ascorbic acid and its metal complexes: Kinetics, RSM optimization, and DFT validation","year":2025,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Advanced Photocatalysis Techniques","field":"Energy","cited_by":2,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Université Laval","funders":"Pakistan Science Foundation","keywords":"Ascorbic acid; Catalysis; Degradation (telecommunications); Metal; Response surface methodology","authors":[{"name":"Anam Shahzadi","is_ca":false},{"name":"Adnan Majeed","is_ca":true},{"name":"Muhammad Adnan Iqbal","is_ca":false},{"name":"Rizwan Ashraf","is_ca":false},{"name":"Faisal Jamil","is_ca":false},{"name":"Mohammad Tauseef Haider","is_ca":false},{"name":"Sabha Khalid","is_ca":false},{"name":"Iqra Yasmeen","is_ca":false},{"name":"Um E. Amara","is_ca":false},{"name":"Rida Fatima","is_ca":false},{"name":"Muhammad Arslan","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.00906238838190611,"gpt":0.2554571556905719,"spread":0.2463947673086657,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.000157617,0.0002691254,0.0004656925,0.0003533443,0.00009079422,0.00003232911,0.0001748365,0.0001276454,0.00003125952],"category_scores_gemma":[0.0001759131,0.0002853581,0.0001043347,0.0008974818,0.0001384289,0.0003389166,0.0001630233,0.000137854,0.000002301269],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00008610373,"about_ca_system_score_gemma":0.00002541498,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00100908,"about_ca_topic_score_gemma":0.0001689555,"domain_scores_codex":[0.9984162,0.0001512644,0.0004661187,0.000527104,0.0002586258,0.0001806155],"domain_scores_gemma":[0.9987144,0.00007371637,0.0003287769,0.0004507973,0.0003677881,0.00006453458],"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":[0.00003785847,0.00008612508,0.00008279802,0.00005405804,0.0005153897,0.00000463683,0.0003413162,0.006467456,0.9863926,0.001413471,0.000006772132,0.004597574],"study_design_scores_gemma":[0.0003724703,0.0000610779,0.0001858103,0.00004574689,0.000680718,0.000004480861,0.0001352038,0.01409881,0.9826112,0.001464602,0.0001082017,0.0002316512],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"methods","genre_gemma":"empirical","genre_scores_codex":[0.4877186,0.0007439958,0.5103828,0.0001011184,0.00001870664,0.0004602942,0.00003548238,0.00009208412,0.0004469801],"genre_scores_gemma":[0.9794517,0.0001026323,0.01869914,0.00007599458,0.000007228145,0.0001104296,0.001348158,0.00003296975,0.0001717738],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.4917331,"threshold_uncertainty_score":0.9999599,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4408291175","doi":"10.1016/j.mcat.2025.115010","title":"Hydrothermal synthesis of calcium methoxide nano-catalyst for palm oil based biolubricant production","year":2025,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Lubricants and Their Additives","field":"Engineering","cited_by":2,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Regina","funders":"Thailand Science Research and Innovation; National Science and Technology Development Agency; Khon Kaen University; National Nanotechnology Center; Thailand Institute of Scientific and Technological Research","keywords":"Catalysis; Methoxide; Palm oil; Sodium methoxide; Chemistry; Nano-; Production (economics); Calcium; Palm; Pulp and paper industry; Organic chemistry; Chemical engineering; Food science; Engineering; Economics","authors":[{"name":"Lalita Attanatho","is_ca":false},{"name":"Amornrat Suemanotham","is_ca":false},{"name":"Yoothana Thanmongkhon","is_ca":false},{"name":"Wanchana Sisuthog","is_ca":false},{"name":"Paweesuda Natewong","is_ca":true},{"name":"Prasert Reubroycharoen","is_ca":false},{"name":"Songyoot Kaewmala","is_ca":false},{"name":"Natthawan Prasongthum","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.007636280520597786,"gpt":0.2267198328307584,"spread":0.2190835523101606,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002414023,0.0002062361,0.0003990073,0.0003219446,0.00005943793,0.00001729848,0.0002112157,0.00007449024,0.00002389099],"category_scores_gemma":[0.0002627102,0.0001925004,0.0003086912,0.0006886621,0.00007748298,0.00006177408,0.00002971176,0.00006237867,0.000005000048],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00007479555,"about_ca_system_score_gemma":0.000046564,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001027524,"about_ca_topic_score_gemma":0.00001148882,"domain_scores_codex":[0.9989006,0.0000491862,0.0003169699,0.0003166528,0.0001532867,0.0002633074],"domain_scores_gemma":[0.9991581,0.00012861,0.00006692821,0.0005065037,0.00008701743,0.00005278979],"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":[0.00002644523,0.00007578565,0.00006921335,0.0003771384,0.0007603305,0.000004763431,0.00005359833,0.008795087,0.945824,0.0002079663,0.0003753306,0.04343029],"study_design_scores_gemma":[0.0001696896,0.00001107303,0.0001347185,0.00008404857,0.0004051685,9.911552e-7,0.00004554724,0.01061061,0.9851558,0.00005530349,0.003130342,0.0001967348],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"methods","genre_gemma":"empirical","genre_scores_codex":[0.4657515,0.002718988,0.521145,0.0007978596,0.0006511623,0.0006273692,0.0006129388,0.0005018589,0.007193353],"genre_scores_gemma":[0.9953356,0.00002247111,0.003843668,0.00004266187,0.00003119772,0.0002870302,0.00009541137,0.00004298535,0.0002989337],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.5295842,"threshold_uncertainty_score":0.7849938,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4362702313","doi":"10.1016/j.mcat.2023.113118","title":"Molecular and biochemical characterization of a recombinant glycosyl hydrolase family 3 β-glucosidase overexpressed in Escherichia. coli; bioprospecting metagenomes for cellulolytic processing function","year":2023,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Biofuel production and bioconversion","field":"Engineering","cited_by":1,"is_retracted":false,"has_abstract":true,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Windsor","funders":"Texas A and M University-Kingsville","keywords":"Glycosyl; Enzyme kinetics; Escherichia coli; Chemistry; Glycoside hydrolase; Hydrolase; Stereochemistry; Substrate (aquarium); Enzyme; Active site; Biochemistry; Biology","authors":[{"name":"Keith E. Taylor","is_ca":true},{"name":"Kim D. Jones","is_ca":false},{"name":"Ahmed S. Mahmoud","is_ca":false},{"name":"Patrick L. Mills","is_ca":false},{"name":"Jean Escudero","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.007432487139529648,"gpt":0.1935507145843677,"spread":0.1861182274448381,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001942107,0.0001781363,0.000258745,0.0003181572,0.00004939749,0.00003800836,0.00007531032,0.0001174222,0.000003770392],"category_scores_gemma":[0.00003353342,0.0001879364,0.00009600823,0.0009480559,0.0000348881,0.000124625,0.00004207744,0.00009787538,0.000004341069],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00005270416,"about_ca_system_score_gemma":0.00001414119,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001550557,"about_ca_topic_score_gemma":4.202669e-7,"domain_scores_codex":[0.9989669,0.00001730388,0.0003082546,0.0003381076,0.0001438407,0.0002255494],"domain_scores_gemma":[0.999597,0.0000111211,0.00008477063,0.0001923611,0.00005486767,0.00005983678],"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":[0.00004180681,0.00003730731,0.00009812311,0.0006113693,0.00005408662,0.000006855718,0.0001129299,0.0004178511,0.9973054,0.000009406178,0.00000843182,0.001296465],"study_design_scores_gemma":[0.0005724412,0.00004134274,0.0008844953,0.00004687815,0.0001069614,0.000001246443,0.00008883914,0.08377646,0.9140161,0.00007494292,0.0001979883,0.0001923029],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9871987,0.0005376423,0.01149015,0.00006659346,0.0001327833,0.0003861704,0.00001254382,0.0001572262,0.00001826133],"genre_scores_gemma":[0.9990968,0.00007038155,0.0002765032,0.00003355236,0.00001627782,0.00006787799,0.0003659317,0.00003992605,0.00003277697],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.08335861,"threshold_uncertainty_score":0.7663826,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4409870635","doi":"10.1016/j.mcat.2025.115146","title":"MoV2MoVI6/h-BN with double terminal oxygen for accelerated aerobic oxidation desulfurization","year":2025,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Catalytic Processes in Materials Science","field":"Materials Science","cited_by":1,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"Western University","funders":"Henan Provincial Science and Technology Research Project; National Natural Science Foundation of China","keywords":"Flue-gas desulfurization; Terminal (telecommunication); Oxygen; Catalysis; Chemistry; Organic chemistry; Computer science; Telecommunications","authors":[{"name":"Ying-Jie Song","is_ca":false},{"name":"Tian-Meng He","is_ca":false},{"name":"Ruo-Ting Liu","is_ca":true},{"name":"Yuhan Dong","is_ca":false},{"name":"Jingyu Pang","is_ca":true},{"name":"Dong‐Bin Dang","is_ca":false},{"name":"Jingyu Pang","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01167406225469165,"gpt":0.2692103836857362,"spread":0.2575363214310445,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0005155763,0.0002328968,0.0002961622,0.0002502387,0.0002621387,0.0004192951,0.0006323574,0.00009285026,0.0001182492],"category_scores_gemma":[0.000131128,0.0002062196,0.00007246835,0.001152803,0.0001640832,0.0004969821,0.0001445486,0.00004991793,0.00007368865],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001382837,"about_ca_system_score_gemma":0.0002692931,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00008194661,"about_ca_topic_score_gemma":0.00003693391,"domain_scores_codex":[0.9981416,0.00003471661,0.0003834512,0.0006878727,0.0003587846,0.0003935996],"domain_scores_gemma":[0.9986881,0.0000414415,0.0001986634,0.0006324634,0.0003648934,0.0000744331],"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":[0.0001979137,0.00005425441,0.00003594814,0.0001048963,0.0000253478,0.00001063631,0.00007876628,0.0012884,0.9967403,0.000859421,0.0001504824,0.0004536149],"study_design_scores_gemma":[0.0009162303,0.00005432122,0.0001370727,0.00004958146,0.0001833536,0.00001248719,0.00003676652,0.001085255,0.9961138,0.0006279772,0.0005370569,0.0002461499],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.7254813,0.00005470907,0.2729159,0.0002886713,0.0001891937,0.0004780959,0.00001276852,0.0001225996,0.0004567982],"genre_scores_gemma":[0.9863557,0.000003675216,0.01184803,0.0003507718,0.000030049,0.000313914,0.0003838916,0.0000248391,0.0006891083],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.2610678,"threshold_uncertainty_score":0.8409392,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4402897542","doi":"10.1016/j.mcat.2024.114580","title":"Organocatalysts for -Lactide polymerization: 2-alkyl- and 2-aryl-1,1,3,3-tetramethylguanidines","year":2024,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"biodegradable polymer synthesis and properties","field":"Materials Science","cited_by":1,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Ottawa","funders":"Instituto Nacional de Ciência e Tecnologia - Oceanografia Integrada e Usos Múltiplos da Plataforma Continental e Oceano Adjacente - Centro de Oceanografia Integrada; Kaohsiung Medical University; National Science and Technology Council","keywords":"Aryl; Alkyl; Polymerization; Lactide; Catalysis; Polymer chemistry; Chemistry; Organic chemistry; Polymer","authors":[{"name":"Rajiv Kamaraj","is_ca":false},{"name":"Prasanna Kumar Ganta","is_ca":false},{"name":"Taoufik Ben Halima","is_ca":true},{"name":"Fei Huang","is_ca":false},{"name":"Venkata Sai Sashankh Penki","is_ca":false},{"name":"Hsi‐Ching Tseng","is_ca":false},{"name":"Shangwu Ding","is_ca":false},{"name":"Hsuan‐Ying Chen","is_ca":false},{"name":"Hsing‐Yin Chen","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01084466121849115,"gpt":0.231686263531187,"spread":0.2208416023126958,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002758453,0.0002288594,0.0002886685,0.0001686077,0.0001985009,0.0004211596,0.0002114357,0.00009657679,0.0002275098],"category_scores_gemma":[0.0001065918,0.0001830895,0.0001463813,0.000420571,0.0001278247,0.0002681944,0.00008395478,0.00006359343,0.00009673199],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00002363042,"about_ca_system_score_gemma":0.0000640709,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000231286,"about_ca_topic_score_gemma":0.00001514177,"domain_scores_codex":[0.9985936,0.00003901298,0.0002749251,0.0005640776,0.000222336,0.0003060937],"domain_scores_gemma":[0.9992968,0.0001174297,0.00004687427,0.0003782342,0.0000526465,0.0001080028],"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":[0.00001782527,0.0000188531,0.00003449082,0.000161187,0.00008074327,0.00001836752,0.0002540729,0.000001363994,0.9605321,0.0009242208,0.0002762561,0.03768051],"study_design_scores_gemma":[0.00008874105,0.00004152994,0.00002101738,0.00004523055,0.0002447922,0.00002834843,0.00009151158,0.0007651054,0.9910967,0.0002725778,0.007045354,0.0002591288],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.7468847,0.2026349,0.04489232,0.003456107,0.0007407914,0.0003415001,0.0001518548,0.0004299465,0.00046791],"genre_scores_gemma":[0.996353,0.0001397438,0.002193904,0.000235927,0.00009964355,0.00008888198,0.00008710047,0.00005372393,0.0007480642],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.2494683,"threshold_uncertainty_score":0.7466171,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4393337114","doi":"10.1016/j.mcat.2024.114094","title":"Fabrication and first-principles calculations of aminoclay-derived nickel nanoparticles for selective semi-hydrogenation of alkynes: The impact of aminopropyl groups","year":2024,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Nanomaterials for catalytic reactions","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Waterloo","funders":"National Natural Science Foundation of China","keywords":"Nickel; Fabrication; Nanoparticle; Catalysis; Combinatorial chemistry; Chemistry; Nanotechnology; Materials science; Organic chemistry; Medicine","authors":[{"name":"Jie Han","is_ca":false},{"name":"Xin Wen","is_ca":false},{"name":"Hongchao Wang","is_ca":false},{"name":"Tianren Wang","is_ca":false},{"name":"Yuzhen Sun","is_ca":false},{"name":"Luis Ricardez‐Sandoval","is_ca":true},{"name":"Guoyi Bai","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.01466085937425343,"gpt":0.2647688342341223,"spread":0.2501079748598689,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001731526,0.0001612937,0.0003083125,0.0001479755,0.00007915898,0.00002643529,0.0001592519,0.00009094529,0.00001688012],"category_scores_gemma":[0.0002213289,0.0001238773,0.000336081,0.000484021,0.000177783,0.0001273688,0.00005860161,0.00005089079,0.000001519814],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001194876,"about_ca_system_score_gemma":0.00009161836,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0007086483,"about_ca_topic_score_gemma":0.00004146101,"domain_scores_codex":[0.9988143,0.00002217228,0.0005296024,0.0002751775,0.0002062149,0.00015249],"domain_scores_gemma":[0.9987124,0.00021794,0.0003036854,0.0004375909,0.0002872047,0.00004119709],"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":[0.00002408922,0.00008590863,0.0009094389,0.0002789029,0.0007231876,8.395928e-7,0.0008478609,0.002424485,0.9938413,0.0005289625,0.00003023377,0.0003048044],"study_design_scores_gemma":[0.0002122386,0.00004401244,0.002494272,0.00005244202,0.0005903899,0.000009021177,0.0002227244,0.02494953,0.9708498,0.0004290594,0.00003659157,0.0001099082],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.994864,0.0008190268,0.003529947,0.00007354683,0.000025274,0.00025626,0.0002945173,0.00003267601,0.0001047044],"genre_scores_gemma":[0.9991062,0.00004491539,0.0002358025,0.000001511139,0.00001900054,0.0001193024,0.0003997402,0.00002877137,0.00004472179],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.02299148,"threshold_uncertainty_score":0.5051568,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4393306178","doi":"10.1016/j.mcat.2024.114091","title":"Monoethanolamine assisted CO2 hydrogenation to methanol – A computational study","year":2024,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Catalysts for Methane Reforming","field":"Chemical Engineering","cited_by":0,"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":"European Regional Development Fund","keywords":"Methanol; Catalysis; Chemistry; Environmental science; Organic chemistry; Waste management; Engineering","authors":[{"name":"Rachid Hadjadj","is_ca":false},{"name":"Imre G. Csizmadia","is_ca":true},{"name":"Hadeer Q. Waleed","is_ca":false},{"name":"Dalal K. Thbayh","is_ca":false},{"name":"Béla Viskolcz","is_ca":false},{"name":"Béla Fiser","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.012458164549149,"gpt":0.2740673162705911,"spread":0.2616091517214421,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0003760731,0.0002745652,0.000350407,0.0006600205,0.00005596475,0.00007604288,0.0002779984,0.00009063377,0.00007289354],"category_scores_gemma":[0.0002018909,0.0002683008,0.0002841534,0.001874862,0.00001743273,0.0001628982,0.000170574,0.0002149172,0.0004158971],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003125585,"about_ca_system_score_gemma":0.00004397683,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002219029,"about_ca_topic_score_gemma":0.00002557634,"domain_scores_codex":[0.997927,0.00004803115,0.0004297653,0.0006039703,0.0006651829,0.0003260991],"domain_scores_gemma":[0.9991241,0.0000914312,0.00004465557,0.0004609454,0.0001009079,0.0001780123],"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":[0.00001372204,0.000198725,0.00006997753,0.00007739603,0.001056178,0.0004034403,0.0009548799,0.04017784,0.9399888,0.0003052232,0.00002977967,0.01672404],"study_design_scores_gemma":[0.0004566847,0.00009281147,0.0002184368,0.00006484578,0.0006352867,0.00007625962,0.0002778039,0.1843136,0.8119069,0.0001395834,0.001294974,0.0005227411],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.885038,0.0004445223,0.1126481,0.0002238963,0.0001205525,0.0004400391,0.00002227838,0.0004824825,0.00058019],"genre_scores_gemma":[0.9966661,8.027753e-7,0.001916656,0.00005759985,0.0000611738,0.0001620274,0.0004330649,0.00008492114,0.0006176523],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.1441358,"threshold_uncertainty_score":0.9999769,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4390927154","doi":"10.1016/j.mcat.2024.113847","title":"Fabrication of NiTi-MMO supported on in-situ generated TiO2 for dioctyl phthalate hydrogenation: A strategy for improving the utilization efficiency of Ni","year":2024,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Nanomaterials for catalytic reactions","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false},"ca_institutions":"University of Waterloo","funders":"National Natural Science Foundation of China","keywords":"Catalysis; Nickel titanium; Nickel; Materials science; Metal; Chemical engineering; Yield (engineering); In situ; Metallurgy; Chemistry; Organic chemistry; Shape-memory alloy","authors":[{"name":"Huafan Li","is_ca":false},{"name":"Weijia Han","is_ca":false},{"name":"Tianli Zhu","is_ca":false},{"name":"Ligong Chen","is_ca":false},{"name":"Luis Ricardez‐Sandoval","is_ca":true},{"name":"Guoyi Bai","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.02745016190948226,"gpt":0.2801255467383642,"spread":0.2526753848288819,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002933802,0.0001606702,0.0002469921,0.000227225,0.00006170537,0.00005139131,0.0001948443,0.0001083032,0.00003976104],"category_scores_gemma":[0.0002040511,0.0001375299,0.0002150171,0.0006724775,0.00005371641,0.0001035335,0.00002370815,0.00005627239,0.000002697342],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001076879,"about_ca_system_score_gemma":0.0001350918,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00008620919,"about_ca_topic_score_gemma":0.00001409383,"domain_scores_codex":[0.9986522,0.00001988146,0.0005684803,0.0003487703,0.0002243593,0.0001863057],"domain_scores_gemma":[0.9989069,0.0001026345,0.0002447499,0.0004401728,0.0002764193,0.00002915948],"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":[0.0000284926,0.0001145215,0.00002161146,0.000459812,0.0001298545,0.000002903681,0.0001372766,0.001025549,0.9934087,0.0007737417,0.00002902126,0.003868465],"study_design_scores_gemma":[0.0003548672,0.00004934132,0.00006677189,0.0000484819,0.0003121871,0.000005390157,0.00008195485,0.04056938,0.9580116,0.00028015,0.0001000658,0.0001198485],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9533246,0.0004122831,0.04444855,0.00007859382,0.0001048338,0.0005131105,0.0002047477,0.0000525529,0.0008607386],"genre_scores_gemma":[0.9967563,0.000006881073,0.0001631874,0.000007164331,0.00003576861,0.0002828732,0.002459686,0.00003801073,0.000250195],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.04428536,"threshold_uncertainty_score":0.5608307,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null},{"id":"W4412078199","doi":"10.1016/j.mcat.2025.115324","title":"Aldol condensation of acetone and furfural on H-Beta zeolite: An ONIOM study","year":2025,"lang":"en","type":"article","venue":"Molecular Catalysis","topic":"Zeolite Catalysis and Synthesis","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":false,"routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false},"ca_institutions":"","funders":"National Research Council of Thailand; Ministry of Higher Education, Science, Research and Innovation, Thailand; Graduate School, Kasetsart University; Kasetsart University; Kasetsart University Research and Development Institute; Landscape Alberta Nursery Trade Association","keywords":"Furfural; ONIOM; Zeolite; Acetone; Aldol condensation; Chemistry; Catalysis; Condensation; Organic chemistry; BETA (programming language); Computer science; Thermodynamics","authors":[{"name":"Bundet Boekfa","is_ca":false},{"name":"Thana Maihom","is_ca":false},{"name":"Sasiwadee Boonya‐udtayan","is_ca":false},{"name":"Rungtiwa Chidthong","is_ca":false},{"name":"Piti Treesukol","is_ca":false},{"name":"Kanokwan Kongpatpanich","is_ca":false},{"name":"Jumras Limtrakul","is_ca":false}],"retraction":null,"screen_n_in":null,"score":{"opus":0.008356237412587689,"gpt":0.2655153049863705,"spread":0.2571590675737828,"validation_status":"score_only:v0-immature-baseline"},"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000252943,0.0002279171,0.0004828136,0.0002452296,0.00008763797,0.00005599475,0.0002640717,0.0001186359,0.0001979908],"category_scores_gemma":[0.00009508574,0.0002180187,0.0001829498,0.000436287,0.00009735736,0.00009208308,0.0001088884,0.0001269678,0.000009514663],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00005348974,"about_ca_system_score_gemma":0.00003556115,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002554217,"about_ca_topic_score_gemma":0.00004406847,"domain_scores_codex":[0.9984186,0.00007540234,0.0004208806,0.0005279984,0.0003460901,0.0002110743],"domain_scores_gemma":[0.9985355,0.00007425873,0.0001491544,0.0010316,0.000118436,0.00009108984],"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":[0.0001112442,0.001096044,0.01922485,0.0001477956,0.001263875,0.00004920617,0.001631216,0.0001006082,0.9584417,0.001497007,0.00005815084,0.01637832],"study_design_scores_gemma":[0.0008601852,0.00008013304,0.007599442,0.00004729295,0.001025712,0.000002444311,0.002684883,0.000605566,0.9862381,0.0001955473,0.0003783878,0.0002823342],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9949816,0.0004150383,0.0001808867,0.000177131,0.00002135008,0.0001166746,0.00003579555,0.00004168582,0.00402982],"genre_scores_gemma":[0.9984369,0.00001204125,0.0001055896,0.0001122477,0.00001681633,0.00003038948,0.000234025,0.00002080809,0.001031242],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.02779639,"threshold_uncertainty_score":0.8890545,"prediction_status":"machine_predicted_unvalidated"},"labels":[],"label_agreement":null}]}