{"id":"W1987917049","doi":"10.1107/s0108270101009544","title":"π-Facial selectivities of diastereotopic ketones:<i>p</i>-bromobenzoates of 4-hetero-1-decalinols","year":2001,"lang":"en","type":"article","venue":"Acta Crystallographica Section C Crystal Structure Communications","topic":"Crystal structures of chemical compounds","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Calgary","funders":"","keywords":"Chemistry; Naphthalene; Decalin; Nucleophile; Benzoates; Stereochemistry; van der Waals force; Medicinal chemistry; Organic chemistry; Catalysis; Molecule","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":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow","insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0001285826,0.0005179452,0.0007826778,0.000408465,0.0003761723,0.00007548868,0.001803433,0.0005186928,0.001161579],"category_scores_gemma":[0.0002049992,0.0005256381,0.0004819078,0.001225776,0.001198231,0.0003761921,0.0007261864,0.0008859477,8.852806e-8],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001222472,"about_ca_system_score_gemma":0.00009697031,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002936884,"about_ca_topic_score_gemma":0.0006572469,"domain_scores_codex":[0.9970158,0.0001320408,0.001181484,0.0005353527,0.0006178321,0.0005174276],"domain_scores_gemma":[0.9956353,0.0005837771,0.0008258831,0.002298692,0.0004624518,0.0001939544],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"not_applicable","study_design_scores_codex":[0.0001712209,0.0002005584,0.01799529,0.0002347723,0.0002426188,0.000001219596,0.0004371575,0.00003910204,0.9794158,0.0001891206,0.000199732,0.0008734422],"study_design_scores_gemma":[0.004285668,0.0005583637,0.03096986,0.0005639113,0.0006282227,0.0007060202,0.002634796,0.0006246225,0.310098,0.03785473,0.6085554,0.002520412],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9917081,0.0007180997,0.0001875209,0.0003489704,0.0001779232,0.000255712,0.0004083649,0.000236906,0.0059584],"genre_scores_gemma":[0.9977033,0.0004503581,0.001077528,0.00004190807,0.000180978,0.00004217679,0.0003405991,0.0000722641,0.00009087234],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.6693178,"threshold_uncertainty_score":0.9997515,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01634208624171232,"score_gpt":0.252059681492663,"score_spread":0.2357175952509507,"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."}}