{"id":"W2015883754","doi":"10.1021/jm301273u","title":"Order and Disorder: Differential Structural Impacts of Myricetin and Ethyl Caffeate on Human Amylase, an Antidiabetic Target","year":2012,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Enzyme Production and Characterization","field":"Biochemistry, Genetics and Molecular Biology","cited_by":157,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of British Columbia","funders":"Canadian Institutes of Health Research","keywords":"Chemistry; Myricetin; Flavonols; Active site; Binding site; Stereochemistry; Combinatorial chemistry; Enzyme; Biochemistry; Polyphenol","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00008107209,0.0002198121,0.000245494,0.0001279533,0.0001733463,0.0003793269,0.0001710151,0.0001834509,0.00117606],"category_scores_gemma":[0.0001979417,0.000159514,0.0001944691,0.00009249343,0.0002777604,0.0003504871,0.0001604924,0.000334466,0.0001883948],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002817027,"about_ca_system_score_gemma":0.0001898301,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001350781,"about_ca_topic_score_gemma":0.002139574,"domain_scores_codex":[0.9999262,0.000006561687,0.000003625672,0.00001576155,0.00002220243,0.00002570191],"domain_scores_gemma":[0.9999026,0.00001644841,0.00003878498,0.000007920564,0.00001106393,0.00002318456],"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":[0.0003382859,0.00002715535,0.001505877,0.00005199633,0.00002491796,0.0001975875,0.0000592865,0.001066097,0.9945358,0.0005176201,0.00007475771,0.001600756],"study_design_scores_gemma":[0.00009451378,0.0004701455,0.04041732,0.00001331438,0.00009895263,0.001003031,0.0001935142,0.01472847,0.937571,0.001164171,0.004216857,0.00002870213],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9969726,0.0008250613,0.001092188,0.00007347982,0.000007330431,0.000004916221,0.00004984013,0.00003761104,0.0009369629],"genre_scores_gemma":[0.998916,0.0002625355,0.0003205857,0.00004131238,0.000003273504,0.000002768148,0.0001126806,0.0000140367,0.0003268922],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001350781,"threshold_uncertainty_score":0.003934324,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.008146361757687728,"score_gpt":0.2762674699128859,"score_spread":0.2681211081551982,"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."}}