{"id":"W3101992928","doi":"10.1021/jacs.0c06518","title":"The Milstein Bipyridyl PNN Pincer Complex of Ruthenium Becomes a Noyori-Type Catalyst under Reducing Conditions","year":2020,"lang":"en","type":"article","venue":"Journal of the American Chemical Society","topic":"Asymmetric Hydrogenation and Catalysis","field":"Chemistry","cited_by":43,"is_retracted":false,"has_abstract":true,"ca_institutions":"Wilfrid Laurier University","funders":"Canada Foundation for Innovation; Compute Canada; Natural Sciences and Engineering Research Council of Canada; Wilfrid Laurier University","keywords":"Chemistry; Ligand (biochemistry); Dimer; Catalysis; Ruthenium; Pincer ligand; Hydride; Piperidine; Stoichiometry; Pincer movement; Medicinal chemistry; Stereochemistry; Photochemistry; Organic chemistry; Hydrogen; Receptor","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":[0.0002016974,0.0001557447,0.000421858,0.00001694534,0.0002158849,0.00003426353,0.0007843319,0.00005765586,0.0002394783],"category_scores_gemma":[0.0003137713,0.00009290571,0.0008470229,0.001037634,0.0006811495,0.00006155345,0.0001792416,0.0004602894,0.000006958291],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000173865,"about_ca_system_score_gemma":0.0001549869,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00005963524,"about_ca_topic_score_gemma":0.000001057341,"domain_scores_codex":[0.9984204,0.00003796699,0.0006112001,0.0001570264,0.0005483595,0.0002250781],"domain_scores_gemma":[0.9977136,0.0003493325,0.001199443,0.0003080059,0.000259096,0.0001705168],"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":[0.00003718845,0.00006378584,0.0004812256,0.00002284718,0.0005776737,8.703404e-7,0.0006632252,0.0001486517,0.9633932,0.00003484323,0.03400419,0.0005723657],"study_design_scores_gemma":[0.0007343101,0.00004904064,0.001034929,0.00003978981,0.0004625532,0.00005543296,0.00757474,0.002424249,0.969776,0.000196282,0.01739343,0.0002592504],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9791867,0.0002553931,0.0001250711,0.01952752,0.00006638884,0.00003901455,0.00004757876,0.00001758355,0.0007347763],"genre_scores_gemma":[0.9971339,0.0001872894,0.0003932453,0.001812412,0.0003255453,0.000001774114,0.00001740317,0.00001997987,0.0001084308],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01794724,"threshold_uncertainty_score":0.3788585,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02458666795534319,"score_gpt":0.2760690651698412,"score_spread":0.251482397214498,"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."}}