{"id":"W4408835841","doi":"10.2174/0115734099353596250313020805","title":"Discovery of Polyphenolic Compounds from Mangifera indica as PotentTherapeutics for Strongyloides stercoralis Infection via Computer-aidedDrug Design","year":2025,"lang":"en","type":"article","venue":"Current Computer - Aided Drug Design","topic":"Mangiferin and Mango Extracts","field":"Medicine","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Alberta","funders":"","keywords":"Mangiferin; Quercetin; Kaempferol; Chemistry; Strongyloides stercoralis; Pharmacology; Docking (animal); Drug; ADME; Biochemistry; Stereochemistry; Biology; Medicine; Antioxidant; Immunology","routes":{"ca_aff":true,"ca_fund":false,"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":[0.0003518652,0.0006390251,0.0007149905,0.0004439936,0.0002425057,0.0006887154,0.0004663691,0.0003695651,0.001650817],"category_scores_gemma":[0.0004265981,0.0002487634,0.0008665601,0.0003407617,0.0001798719,0.0003075419,0.0003092805,0.0004426145,0.0002592223],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0006138626,"about_ca_system_score_gemma":0.001056919,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0017618,"about_ca_topic_score_gemma":0.003249753,"domain_scores_codex":[0.9999032,0.00001871734,0.000005363538,0.00002178841,0.00003478293,0.00001615586],"domain_scores_gemma":[0.9999024,0.0000370503,0.00002609545,0.000005310448,0.00002047396,0.000008646597],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"simulation_or_modeling","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.0008567687,0.0006715661,0.007881592,0.002707686,0.000389658,0.0007045366,0.00008698535,0.5522534,0.2763763,0.01208954,0.002984654,0.1429974],"study_design_scores_gemma":[0.0002667614,0.001523025,0.001889222,0.00008475772,0.0003387189,0.0002453028,0.0000579841,0.9044555,0.07305833,0.001625595,0.01640544,0.00004931622],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.7806123,0.02659377,0.1703219,0.001369769,0.0002031099,0.0007470436,0.002264298,0.00135123,0.01653654],"genre_scores_gemma":[0.852649,0.00987145,0.1323426,0.0001917458,0.00002084164,0.0005347345,0.001543507,0.00006890731,0.002777361],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0017618,"threshold_uncertainty_score":0.00552249,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.04348863147409981,"score_gpt":0.3141550421194494,"score_spread":0.2706664106453496,"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."}}