{"id":"W4390696698","doi":"10.3390/molecules29020343","title":"Mode of Antibacterial Action of Tomatidine C3-Diastereoisomers","year":2024,"lang":"en","type":"article","venue":"Molecules","topic":"Synthesis and biological activity","field":"Chemistry","cited_by":8,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université de Sherbrooke","funders":"Natural Sciences and Engineering Research Council of Canada; Mitacs; Cystic Fibrosis Canada; Québec Consortium for Drug Discovery","keywords":"Diastereomer; Mode of action; Action (physics); Mode (computer interface); Stereochemistry; Chemistry; Antibacterial activity; Combinatorial chemistry; Bacteria; Physics; Biology; Biochemistry; Computer science; Genetics; Quantum mechanics","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":[0.0001950974,0.0003545175,0.0002595455,0.0002055306,0.00008905494,0.0002164204,0.0002270572,0.0002893412,0.001393877],"category_scores_gemma":[0.0001940288,0.0001166783,0.0002793262,0.0001341205,0.0001702463,0.0001682337,0.0001974895,0.0004185732,0.0003789587],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001996823,"about_ca_system_score_gemma":0.0001808219,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004651046,"about_ca_topic_score_gemma":0.00031194,"domain_scores_codex":[0.99986,0.00003286229,0.0000156483,0.00002933189,0.00002443476,0.00003763859],"domain_scores_gemma":[0.9998866,0.00002408339,0.00002885792,0.00001511917,0.0000177355,0.0000275016],"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":[0.0003660514,0.00003408909,0.0001713546,0.00006533646,0.00001051879,0.00008934669,0.00002211465,0.0001634176,0.9967944,0.0002368575,0.00006713855,0.00197928],"study_design_scores_gemma":[0.00003904661,0.0009047041,0.0005987598,0.000006557702,0.00001580767,0.0002024681,0.00001816175,0.0005267536,0.9956261,0.00004371512,0.002010319,0.000007574622],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9905804,0.001734171,0.002683692,0.000104479,0.00004669505,0.00009725311,0.0005675749,0.00005523619,0.004130525],"genre_scores_gemma":[0.9942299,0.001075418,0.002803433,0.0001011722,0.00001383861,0.00007582146,0.000393544,0.0000198926,0.001286848],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001393877,"threshold_uncertainty_score":0.004662991,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02533371254250782,"score_gpt":0.2800866281108932,"score_spread":0.2547529155683854,"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."}}