{"id":"W2411943562","doi":"10.1021/acs.orglett.5b01679","title":"γ-Turn Mimicry with Benzodiazepinones and Pyrrolobenzodiazepinones Synthesized from a Common Amino Ketone Intermediate","year":2015,"lang":"en","type":"article","venue":"Organic Letters","topic":"Synthesis and pharmacology of benzodiazepine derivatives","field":"Chemistry","cited_by":33,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université de Montréal","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Chemistry; Dihedral angle; Ozonolysis; Ketone; Intramolecular force; Aniline; Acylation; Stereochemistry; Ring (chemistry); Amino acid; Olefin fiber; Turn (biochemistry); Medicinal chemistry; Organic chemistry; Molecule; Catalysis; Biochemistry","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":[0.0002402888,0.0005512632,0.0007753342,0.0001201331,0.0001548877,0.0001127237,0.0004915318,0.0002236655,0.001392371],"category_scores_gemma":[0.0001545962,0.0004684672,0.00009473586,0.0001698059,0.0005493904,0.0003239902,0.000202604,0.0004399718,0.0001217288],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001144588,"about_ca_system_score_gemma":0.00009089889,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003243644,"about_ca_topic_score_gemma":0.0001107816,"domain_scores_codex":[0.9976472,0.0001410732,0.0004793005,0.0007511912,0.0003635701,0.0006177227],"domain_scores_gemma":[0.9979661,0.0006689434,0.0003205858,0.0005427836,0.00007044544,0.0004311977],"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":[0.0004857318,0.0001409376,0.04244819,0.0000634256,0.0003949153,0.0001779054,0.002227157,0.000003640759,0.945488,0.00001367906,0.005115857,0.003440511],"study_design_scores_gemma":[0.004710896,0.0001266081,0.03612776,0.0002525223,0.0004023444,0.0001223104,0.001644984,0.0002310617,0.9500883,0.0001743183,0.0049707,0.001148253],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9911476,0.00101418,0.00009106501,0.006435993,0.0002347677,0.0001500394,0.0001197811,0.0002635155,0.0005430673],"genre_scores_gemma":[0.9945564,0.0001421426,0.0006553614,0.003804413,0.0005241996,0.00005163485,0.00009108493,0.0001083707,0.0000663858],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.006320433,"threshold_uncertainty_score":0.9997767,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0166716285096795,"score_gpt":0.2307924837889359,"score_spread":0.2141208552792563,"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."}}