{"id":"W2074472883","doi":"10.1021/jp102399h","title":"Redox Mechanism of Glycosidic Bond Hydrolysis Catalyzed by 6-Phospho-α-glucosidase: A DFT Study","year":2010,"lang":"en","type":"article","venue":"The Journal of Physical Chemistry B","topic":"Enzyme Catalysis and Immobilization","field":"Biochemistry, Genetics and Molecular Biology","cited_by":32,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Windsor","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Chemistry; Glycosidic bond; Stereochemistry; Bond cleavage; Heterolysis; Half-reaction; Pyranose; Redox; Regioselectivity; Catalysis; Hydroxylation; Organic chemistry; Enzyme","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":[0.0004206098,0.0001732832,0.0003159753,0.00001529496,0.00006641397,0.00001456871,0.0004778781,0.00009961599,0.00003653269],"category_scores_gemma":[0.0001187204,0.0001185611,0.0002354866,0.0001591526,0.00009528893,0.00000948121,0.0001093802,0.0003005187,0.000002250917],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000009992352,"about_ca_system_score_gemma":0.00006506131,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001392545,"about_ca_topic_score_gemma":0.000003796122,"domain_scores_codex":[0.9989008,0.00004381668,0.0004016939,0.0001697835,0.0003222167,0.0001616375],"domain_scores_gemma":[0.9986289,0.0000371533,0.0004930314,0.0005152941,0.0002261468,0.00009943978],"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":[0.0001399536,0.0007190061,0.00004111966,0.000019853,0.0001705282,0.000001679262,0.0001503843,0.00002161584,0.9974142,0.00001094637,0.001208771,0.0001019237],"study_design_scores_gemma":[0.0007409514,0.0003147415,0.0000440835,0.00001030517,0.0002648,0.00002906378,0.0003298703,0.0001180105,0.9974031,0.00009842244,0.0005211186,0.0001255357],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9990462,0.0002826097,0.0002666289,0.00006237091,0.000042748,0.00009847076,0.0000216782,0.000003303386,0.0001759662],"genre_scores_gemma":[0.999308,0.00003887399,0.00002510853,0.00002275747,0.0003120228,0.000004267843,0.00005349117,0.00002108324,0.0002144296],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0006876529,"threshold_uncertainty_score":0.4834781,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.003595651517373896,"score_gpt":0.2281520413012126,"score_spread":0.2245563897838387,"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."}}