{"id":"W1976280255","doi":"10.1021/cs401065n","title":"Deracemization of 2-Methyl-1,2,3,4-Tetrahydroquinoline Using Mutant Cyclohexylamine Oxidase Obtained by Iterative Saturation Mutagenesis","year":2014,"lang":"en","type":"article","venue":"ACS Catalysis","topic":"Enzyme Catalysis and Immobilization","field":"Biochemistry, Genetics and Molecular Biology","cited_by":55,"is_retracted":false,"has_abstract":true,"ca_institutions":"McGill University; National Research Council Canada; Centre in Green Chemistry and Catalysis","funders":"","keywords":"Saturated mutagenesis; Chemistry; Flavin group; Cyclohexylamine; Enantiomeric excess; Mutagenesis; Stereoselectivity; Substrate (aquarium); Kinetic resolution; Biocatalysis; Amine gas treating; Stereochemistry; Mutant; Combinatorial chemistry; Catalysis; Organic chemistry; Biochemistry; Enantioselective synthesis; Reaction mechanism; Biology; Enzyme; Gene","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":[],"consensus_categories":[],"category_scores_codex":[0.00028304,0.0002267089,0.0003123078,0.0001336063,0.0001129132,0.00003494773,0.0001622895,0.000183578,0.00001962654],"category_scores_gemma":[0.0004115959,0.0002166156,0.0001410352,0.000506131,0.00007473311,0.00002864607,0.00007014226,0.00005724583,0.000003146782],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00003261512,"about_ca_system_score_gemma":0.00003679478,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00005340483,"about_ca_topic_score_gemma":0.00002700993,"domain_scores_codex":[0.9984995,0.0001393766,0.0004880581,0.0004553736,0.0002140021,0.0002036938],"domain_scores_gemma":[0.9987193,0.00003259703,0.0003431144,0.0005123233,0.0003224712,0.00007023026],"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":[0.000042189,0.0001024763,0.0006180618,0.00002644437,0.0001306401,3.70518e-7,0.000100398,0.002935943,0.9938958,0.00002350154,0.000212107,0.00191205],"study_design_scores_gemma":[0.0004746598,0.0001361965,0.0002826491,0.00001446154,0.0001983054,0.000005132771,0.00006385105,0.01314276,0.98407,0.0000125782,0.001364472,0.0002349462],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.915382,0.0005947647,0.08362961,0.00004584976,0.00005413855,0.0001624567,0.00005334317,0.00001454165,0.00006330701],"genre_scores_gemma":[0.9909542,0.0001637414,0.001157457,0.0001123617,0.0001327326,0.00001635319,0.007176172,0.00003400602,0.0002529977],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.08247215,"threshold_uncertainty_score":0.8833329,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.00642414280092787,"score_gpt":0.238398678939893,"score_spread":0.2319745361389652,"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."}}