{"id":"W2329740883","doi":"10.1021/ja202732q","title":"Experimental Investigations of a Partial Ru–O Bond during the Metal–Ligand Bifunctional Addition in Noyori-Type Enantioselective Ketone Hydrogenation","year":2011,"lang":"en","type":"article","venue":"Journal of the American Chemical Society","topic":"Asymmetric Hydrogenation and Catalysis","field":"Chemistry","cited_by":71,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Alberta","funders":"","keywords":"Chemistry; Bifunctional; Enantioselective synthesis; Ruthenium; Ketone; BINAP; Intramolecular force; Ligand (biochemistry); Methyl vinyl ketone; Medicinal chemistry; Transition metal; Noyori asymmetric hydrogenation; Alkoxide; Stereochemistry; Catalysis; Organic chemistry","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":[0.0002853424,0.000358415,0.0003149537,0.000125622,0.0003643319,0.0002021605,0.0005254847,0.0003894813,0.001356745],"category_scores_gemma":[0.000302894,0.0001727741,0.0001239368,0.0001952712,0.0003905953,0.0003472569,0.0002563252,0.0006768174,0.0002655312],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002535791,"about_ca_system_score_gemma":0.0001352747,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0009386091,"about_ca_topic_score_gemma":0.001255274,"domain_scores_codex":[0.9997491,0.0000431971,0.000009672905,0.00006011972,0.0000500156,0.00008781738],"domain_scores_gemma":[0.9998105,0.00005618674,0.00004773575,0.000035828,0.000025095,0.00002450888],"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":[0.0003158649,0.00004103197,0.0002169586,0.00009002219,0.000009662242,0.0001329975,0.000144717,0.0001952615,0.9966584,0.000499461,0.0000586311,0.00163687],"study_design_scores_gemma":[0.00001255007,0.0001323183,0.0005618497,0.000002740862,0.000006834519,0.00006251085,0.00003409779,0.0004326446,0.998256,0.00003130126,0.0004600564,0.000007141499],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9952711,0.0002580773,0.002245073,0.00002903533,0.000006249722,0.00002742728,0.0001806622,0.00003314416,0.001949228],"genre_scores_gemma":[0.9978479,0.0002069618,0.001167519,0.00001239997,0.000003727395,0.00002143303,0.00009903071,0.000009831098,0.000631108],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001356745,"threshold_uncertainty_score":0.004538774,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01602977590439417,"score_gpt":0.2385181066004312,"score_spread":0.222488330696037,"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."}}