{"id":"W4400871417","doi":"10.1016/j.ejmech.2024.116692","title":"Candida antarctica Lipase B mediated kinetic resolution: A sustainable method for chiral synthesis of antiproliferative β-lactams","year":2024,"lang":"en","type":"article","venue":"European Journal of Medicinal Chemistry","topic":"Enzyme Catalysis and Immobilization","field":"Biochemistry, Genetics and Molecular Biology","cited_by":5,"is_retracted":false,"has_abstract":true,"ca_institutions":"Trinity College","funders":"Trinity College Dublin; Royal Society of Chemistry","keywords":"Chemistry; Kinetic resolution; Enantiomer; Substituent; Biocatalysis; Candida antarctica; Lactam; Stereochemistry; Enantiomeric excess; Enantioselective synthesis; Diastereomer; Substrate (aquarium); Racemic mixture; Lipase; Combinatorial chemistry; Organic chemistry; Catalysis; Enzyme; Reaction mechanism","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":[0.0002155505,0.0007049103,0.0003507685,0.0002983038,0.0001710449,0.0004161897,0.000496456,0.0005792997,0.0006694985],"category_scores_gemma":[0.0001695383,0.0002347633,0.0003461436,0.0003372097,0.0001714173,0.0004165872,0.000404351,0.0007978304,0.0008394875],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003009042,"about_ca_system_score_gemma":0.0002887787,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0008871445,"about_ca_topic_score_gemma":0.001352461,"domain_scores_codex":[0.999791,0.00003913531,0.00001969144,0.00003763843,0.00007117584,0.00004146296],"domain_scores_gemma":[0.9999429,0.00000648973,0.00001917994,0.000007468095,0.00001192527,0.00001206585],"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":[0.00003552065,0.00002364804,0.00005595877,0.0001229809,0.000009500846,0.0001231812,0.00001552305,0.0001321905,0.9951606,0.0001461992,0.0001170399,0.004057688],"study_design_scores_gemma":[0.000005855592,0.00006340217,0.0002011365,0.000007124777,0.000007153925,0.0001604001,0.0000123454,0.0004451464,0.9957504,0.0000326372,0.003306371,0.000008020219],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8860666,0.02322554,0.07170524,0.00126968,0.0002532139,0.0003101893,0.001509371,0.0007471871,0.01491303],"genre_scores_gemma":[0.9528881,0.009786266,0.03151043,0.0002459625,0.00003412241,0.00008918296,0.0007049488,0.00008704221,0.004654028],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0008871445,"threshold_uncertainty_score":0.002239704,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.007885369477850939,"score_gpt":0.264925440759813,"score_spread":0.257040071281962,"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."}}