{"id":"W2091836052","doi":"10.1021/jm990090m","title":"A Study of the Relationship between Biological Activity and Prolyl Amide Isomer Geometry in Oxytocin Using 5-<i>tert</i>-Butylproline To Augment the Cys<sup>6</sup>-Pro<sup>7</sup>Amide<i>Cis</i>-Isomer Population","year":2000,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Chemical Synthesis and Analysis","field":"Biochemistry, Genetics and Molecular Biology","cited_by":33,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université de Montréal","funders":"","keywords":"Oxytocin; Chemistry; Population; Pharmacophore; Stereochemistry; Oxytocin receptor; Potency; Peptide synthesis; Amide; Structure–activity relationship; Peptide; Receptor; In vitro; Biochemistry; Endocrinology; Biology","routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000135075,0.0002248306,0.0001500376,0.00006158826,0.00005944083,0.0001880971,0.0001592851,0.0001801444,0.0005302699],"category_scores_gemma":[0.0003017684,0.00009196136,0.0001033833,0.0001007198,0.0001544829,0.0001866901,0.00008998284,0.0002678133,0.0001358402],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00011688,"about_ca_system_score_gemma":0.00007730731,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002146823,"about_ca_topic_score_gemma":0.000214191,"domain_scores_codex":[0.9999036,0.00002822647,0.000005177464,0.00002033959,0.00002393001,0.00001881773],"domain_scores_gemma":[0.9998164,0.00006779859,0.00006936953,0.000008088265,0.00001404756,0.00002432201],"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":[0.0000916197,0.00001036903,0.0001302398,0.00002634134,0.000003512876,0.00003321329,0.00001129014,0.0001098931,0.9982818,0.00004616811,0.000007296785,0.001248088],"study_design_scores_gemma":[0.00001067056,0.001226263,0.002890287,0.00000431744,0.00001689835,0.0002192471,0.0000307283,0.0008339969,0.9938291,0.00002547029,0.0009060568,0.000007021671],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9968168,0.001267259,0.001003663,0.00002326108,0.000006257686,0.00001266567,0.00007214401,0.000009256466,0.000788695],"genre_scores_gemma":[0.9979045,0.0006946844,0.0009789719,0.00001801305,0.000005153913,0.000008984857,0.00009399914,0.00000434032,0.0002913506],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0005302699,"threshold_uncertainty_score":0.001773953,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.03638941865579138,"score_gpt":0.2973874170944583,"score_spread":0.2609979984386669,"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."}}