{"id":"W4307840887","doi":"10.1039/d2ob01369j","title":"A mechanistic study of thiol addition to <i>N</i>-phenylacrylamide","year":2022,"lang":"en","type":"article","venue":"Organic & Biomolecular Chemistry","topic":"Click Chemistry and Applications","field":"Chemistry","cited_by":10,"is_retracted":false,"has_abstract":true,"ca_institutions":"Carleton University; University of Ottawa","funders":"Natural Sciences and Engineering Research Council of Canada; Canadian Institutes of Health Research","keywords":"Chemistry; Thiol; Nucleophile; Cysteine; Protonation; Covalent bond; Electrophile; Active site; Alkyl; Leaving group; Combinatorial chemistry; Residue (chemistry); Stereochemistry; Enzyme; Organic chemistry","routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow","insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0001366416,0.000264946,0.000284814,0.00002740976,0.0003244978,0.00002341634,0.0006807487,0.00008938144,0.01994678],"category_scores_gemma":[0.0001083536,0.0003260973,0.000117157,0.0006228302,0.00003639133,0.00002538065,0.0005524131,0.0003343544,0.0000357459],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001948278,"about_ca_system_score_gemma":0.0001070581,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00002725329,"about_ca_topic_score_gemma":0.000002563652,"domain_scores_codex":[0.9980267,0.00002213524,0.0004573168,0.0006273254,0.0005439176,0.0003226],"domain_scores_gemma":[0.9984635,0.00004839698,0.0002110557,0.001011182,0.0000815326,0.0001842965],"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":[0.00004009596,0.001205506,0.00003359366,0.0001540084,0.00007192315,0.00004216647,0.0003536127,0.000008606405,0.9969736,0.00002025067,0.0008327968,0.0002638637],"study_design_scores_gemma":[0.0007381752,0.00006293234,0.000008174325,0.00001832994,0.0000934937,0.00007552947,0.003675906,0.00004886317,0.9889264,0.0001591815,0.0058658,0.0003272676],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9853385,0.00005879403,0.005094366,0.0001707307,0.00003478382,0.0002518973,0.0003573066,0.0001822751,0.008511351],"genre_scores_gemma":[0.9974713,0.000002380659,0.0001160946,0.0001202785,0.0000942271,0.0004313544,0.0002680737,0.00005938561,0.00143693],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01991103,"threshold_uncertainty_score":0.9999191,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.007248831701105861,"score_gpt":0.2252401807908971,"score_spread":0.2179913490897913,"validation_status":"score_only:v0-immature-baseline","note":"Baseline scores from an immature model (maturity gate not passed). Scores rank; they never assert a category."}}