{"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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001734643,0.000119504,0.0001805692,0.00002709366,0.00005062252,0.000009648549,0.00006539452,0.0001021674,0.00007573527],"category_scores_gemma":[0.00009576196,0.00009248318,0.00002942804,0.00004017049,0.0001041574,0.00001409201,0.00002790863,0.0001544259,1.018692e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000006710157,"about_ca_system_score_gemma":0.00002513162,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000004212898,"about_ca_topic_score_gemma":7.294129e-7,"domain_scores_codex":[0.9992844,0.00003386729,0.0002521798,0.0001127432,0.0001694336,0.0001473863],"domain_scores_gemma":[0.9993222,0.000006961577,0.0002710423,0.0001048017,0.0001113013,0.000183729],"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":[0.0001172878,0.00006343782,0.04307531,0.00010428,0.00002726185,0.000001149186,0.0001237555,0.000001695098,0.955832,0.000002342667,0.0001113652,0.0005400941],"study_design_scores_gemma":[0.0009175336,0.0004415965,0.1047066,0.00005049366,0.00004754097,0.0001622961,0.0001950891,0.000008342043,0.8929098,0.00001457079,0.00044175,0.0001044031],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9984416,0.001116452,0.00005103654,0.0001768648,0.0001189028,0.0000328899,0.000007093712,0.000002090316,0.00005301521],"genre_scores_gemma":[0.9986333,0.0002515766,0.0001063267,0.00005427853,0.0008282966,4.718677e-7,0.0000491613,0.00001091204,0.00006569294],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.06292225,"threshold_uncertainty_score":0.3771355,"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."}}