{"id":"W1858521883","doi":"10.1039/c5sc01958c","title":"Mechanistic investigation of aziridine aldehyde-driven peptide macrocyclization: the imidoanhydride pathway","year":2015,"lang":"en","type":"article","venue":"Chemical Science","topic":"Synthesis and Catalytic Reactions","field":"Chemistry","cited_by":33,"is_retracted":false,"has_abstract":true,"ca_institutions":"Aegera Therapeutics (Canada); University of Toronto; Toronto Public Health","funders":"Natural Sciences and Engineering Research Council of Canada; Canadian Institutes of Health Research; Ontario Genomics Institute; Québec Consortium for Drug Discovery; Ontario Genomics","keywords":"Aziridine; Aldehyde; Peptide; Chemistry; Combinatorial chemistry; Stereochemistry; Biochemistry; Organic chemistry; Catalysis; Ring (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":[],"consensus_categories":[],"category_scores_codex":[0.0003129911,0.00009622828,0.0001177823,0.00002580634,0.0001123905,0.00004224251,0.0005294955,0.00004880429,0.0001281783],"category_scores_gemma":[0.0009133183,0.00006594839,0.00004555336,0.0004378645,0.0007183799,0.0001501643,0.0001172509,0.00009601464,0.00003501906],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001194737,"about_ca_system_score_gemma":0.0002217657,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00002961934,"about_ca_topic_score_gemma":0.000002265969,"domain_scores_codex":[0.9987798,0.000006976863,0.0002296723,0.0002594405,0.0005216344,0.0002025092],"domain_scores_gemma":[0.9989966,0.0001226258,0.0001321333,0.0003745607,0.0001761833,0.0001979447],"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":[0.000003423277,0.00001383472,0.0003470211,0.00001038746,0.00000291166,5.197426e-7,0.0001813599,0.0000362982,0.9963113,0.00213253,0.0004232955,0.0005371185],"study_design_scores_gemma":[0.0001005916,0.000004439409,0.0000868154,0.00002927016,0.00001345338,0.00001520666,0.0002178485,0.003087071,0.9913548,0.003478481,0.001525255,0.00008677313],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9731435,0.00003259325,0.0004590077,0.0006449404,0.00008704812,0.00005217108,0.000009124397,0.0000483447,0.02552333],"genre_scores_gemma":[0.9990609,0.000004582588,0.0004512806,0.00007206232,0.0001109948,0.00001561425,0.00001125648,0.000007355082,0.0002659808],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.02591744,"threshold_uncertainty_score":0.2689297,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.03435325187586951,"score_gpt":0.2480101600928251,"score_spread":0.2136569082169556,"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."}}