{"id":"W2522197822","doi":"10.1128/aac.01436-16","title":"Triazole Substitution of a Labile Amide Bond Stabilizes Pantothenamides and Improves Their Antiplasmodial Potency","year":2016,"lang":"en","type":"article","venue":"Antimicrobial Agents and Chemotherapy","topic":"Neurological diseases and metabolism","field":"Neuroscience","cited_by":39,"is_retracted":false,"has_abstract":true,"ca_institutions":"McGill University","funders":"Canadian Institutes of Health Research","keywords":"Amide; Enzyme; Plasmodium falciparum; Coenzyme A; Biosynthesis; Biochemistry; Potency; Kinase; In vivo; Phosphorylation; Chemistry; Drug discovery; Transferase; Stereochemistry; Biology; Structure–activity relationship; In vitro; Genetics","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":[0.00008160176,0.0001841382,0.0002751393,0.00004824786,0.0001138124,0.00003913552,0.0001228075,0.00007032915,0.00006554603],"category_scores_gemma":[0.00007795145,0.0001031811,0.00008190009,0.00008950955,0.0004343957,0.0001851013,0.00005074644,0.00005048064,0.000002876189],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000004931142,"about_ca_system_score_gemma":0.00002094024,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00002827949,"about_ca_topic_score_gemma":0.000002857574,"domain_scores_codex":[0.9989367,0.00005621995,0.0002403987,0.0004069962,0.0001013201,0.0002583938],"domain_scores_gemma":[0.9994822,0.0001159017,0.000120733,0.0001626912,0.00002434076,0.00009412543],"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":[0.000446001,0.0001600309,0.002596762,0.00002502497,0.000007334987,0.000003312797,0.00009490509,1.883365e-7,0.9635448,0.00104348,0.0003037264,0.03177439],"study_design_scores_gemma":[0.002675861,0.000181621,0.0647286,0.00003579462,0.00001591725,0.00001238746,0.00001352283,0.00002201081,0.9171023,0.001382775,0.01363713,0.0001920366],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9980764,0.00006531002,0.00006193626,0.001043683,0.0001400273,0.0002998046,0.0001442529,0.00003853382,0.0001300707],"genre_scores_gemma":[0.9907175,0.006325124,0.00005026999,0.002700727,0.00005931488,0.000005690837,0.000001196527,0.0000160922,0.0001240513],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.06213184,"threshold_uncertainty_score":0.4207604,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02003554302590233,"score_gpt":0.2386474074782355,"score_spread":0.2186118644523332,"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."}}