{"id":"W2027754238","doi":"10.1016/j.ica.2014.07.073","title":"Alkene hydroamination with a chiral zirconium catalyst. Connecting ligand design, precatalyst structure and reactivity trends","year":2014,"lang":"en","type":"article","venue":"Inorganica Chimica Acta","topic":"Asymmetric Hydrogenation and Catalysis","field":"Chemistry","cited_by":17,"is_retracted":false,"has_abstract":false,"ca_institutions":"University of British Columbia","funders":"Natural Sciences and Engineering Research Council of Canada; Canada Research Chairs","keywords":"Hydroamination; Chemistry; Alkene; Pyrrolidine; Reactivity (psychology); Intramolecular force; Catalysis; Ligand (biochemistry); Zirconium; Enantiomer; Enantioselective synthesis; Stereochemistry; Medicinal chemistry; Organic chemistry","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"],"consensus_categories":[],"category_scores_codex":[0.0002483472,0.0003541085,0.0004277647,0.0002488363,0.0002847633,0.00013711,0.0003148299,0.0002474019,0.0002190007],"category_scores_gemma":[0.0003478095,0.0003053358,0.00007242755,0.0007542458,0.0001003296,0.0003360123,0.0001277585,0.0003772055,0.000007898769],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001106062,"about_ca_system_score_gemma":0.00005150307,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00005246505,"about_ca_topic_score_gemma":0.000100222,"domain_scores_codex":[0.9981693,0.00006580863,0.0003495546,0.0006788748,0.0003733663,0.0003631167],"domain_scores_gemma":[0.9984475,0.0002760073,0.0003537217,0.00062387,0.00009550535,0.00020335],"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":[0.00006097458,0.00007788349,0.0006183051,0.00003946578,0.0001660063,0.000002300184,0.0005663764,0.000006510033,0.9879616,0.00003224981,0.000114025,0.01035424],"study_design_scores_gemma":[0.00108945,0.00006405015,0.001724315,0.00002905035,0.0002476373,0.000173311,0.0001111507,0.002676203,0.9909325,0.00006470292,0.002444011,0.000443669],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9915581,0.00003341243,0.0006681459,0.0005279818,0.0000365712,0.00007600715,0.00005133459,0.0001976765,0.006850718],"genre_scores_gemma":[0.9980782,0.00001139044,0.0005839496,0.00008255619,0.0001751353,0.00000952186,0.0003765796,0.00006513186,0.0006175749],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.009910573,"threshold_uncertainty_score":0.9999399,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.007567851943407142,"score_gpt":0.2075661825001202,"score_spread":0.199998330556713,"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."}}