{"id":"W3045923623","doi":"10.1021/acs.biochem.0c00478","title":"Potent Inhibition of Mandelate Racemase by Boronic Acids: Boron as a Mimic of a Carbon Acid Center","year":2020,"lang":"en","type":"article","venue":"Biochemistry","topic":"Biochemical and Molecular Research","field":"Biochemistry, Genetics and Molecular Biology","cited_by":14,"is_retracted":false,"has_abstract":true,"ca_institutions":"Dalhousie University","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Chemistry; Phenylboronic acid; Boronic acid; Hydrolysis; Substrate (aquarium); Active site; Stereochemistry; Catalysis; Boron; 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":[],"consensus_categories":[],"category_scores_codex":[0.00008496801,0.0002063365,0.0002316695,0.00001717072,0.00002202443,0.000008106242,0.0002116672,0.00031314,0.00003651223],"category_scores_gemma":[0.000106254,0.000202936,0.0001779707,0.0001113796,0.0001713048,0.000002767533,0.0002470092,0.000163469,0.000004503017],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00002182757,"about_ca_system_score_gemma":0.0001216523,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00003029357,"about_ca_topic_score_gemma":7.800143e-7,"domain_scores_codex":[0.9985981,0.00003571287,0.0003367526,0.0004630985,0.0002733105,0.000293028],"domain_scores_gemma":[0.999164,0.000003873276,0.0001493976,0.0003536352,0.0001168611,0.0002122557],"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":[0.0004356118,0.000176093,0.0002197849,0.0002867334,0.0000748813,0.00000808047,0.00002844657,9.916342e-7,0.9955781,0.000003433416,0.002633499,0.0005544035],"study_design_scores_gemma":[0.001179655,0.0003589225,0.00001957061,0.00005748908,0.00002521742,0.00001527033,0.00005507278,0.0000371592,0.9955311,0.00001369819,0.002508745,0.0001980587],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9928352,0.004689131,0.0001032498,0.0006612663,0.00002072736,0.0001741012,0.0001484733,0.0000115588,0.001356355],"genre_scores_gemma":[0.998166,0.0004373251,0.0001100101,0.0002923098,0.00008661991,0.00001738141,0.0006681906,0.00002810164,0.0001941165],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.005330809,"threshold_uncertainty_score":0.827549,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.007036431705356835,"score_gpt":0.2357096317502788,"score_spread":0.2286732000449219,"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."}}