{"id":"W4413902654","doi":"10.1002/fsn3.70875","title":"Investigating the Chemical–Biological Link in <i>Ziziphora galinae</i> Extracts for the Discovery of Novel Raw Materials via <i>In Silico</i> and In Vitro Assays","year":2025,"lang":"en","type":"article","venue":"Food Science & Nutrition","topic":"Essential Oils and Antimicrobial Activity","field":"Agricultural and Biological Sciences","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Calgary","funders":"Ministry of Education; Ministry of Health","keywords":"In silico; Chemistry; Rutin; Binding affinities; Cytotoxicity; In vitro; Enzyme; Caffeic acid; IC50; Antifungal; Asteraceae; Biochemistry; Antioxidant; Biology; Botany; Microbiology","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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.001218591,0.00009858215,0.0001914814,0.00002531499,0.0001541264,0.0001266058,0.0003033478,0.00008106103,0.000001276399],"category_scores_gemma":[0.0002414146,0.00003436444,0.00003958042,0.0008362613,0.0005281184,0.0003142993,0.0001158779,0.0001268487,1.203994e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00002616457,"about_ca_system_score_gemma":0.00001923885,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003608428,"about_ca_topic_score_gemma":0.0004631789,"domain_scores_codex":[0.9989624,0.00006350964,0.0002951219,0.0002983974,0.000122747,0.0002577998],"domain_scores_gemma":[0.9991688,0.0006142112,0.0001030627,0.00005315302,0.00003810425,0.00002268494],"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":[0.00005933257,0.0002172372,0.0005131438,0.00002241413,8.37324e-7,1.84174e-7,0.00003305306,0.000005397288,0.9957172,0.0003180972,0.000007346486,0.00310574],"study_design_scores_gemma":[0.0003488212,0.00008156672,0.02939377,0.0001605699,0.000002782094,0.000001549721,0.0001268054,0.0002727577,0.9671951,0.002299401,0.00004070198,0.00007619875],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9943641,0.0001488836,0.00004062073,0.004778615,0.00009372502,0.0004857353,0.00005882048,0.000006504729,0.00002301046],"genre_scores_gemma":[0.9993184,0.00007590467,0.0001323363,0.0003340807,0.00006954481,0.00005213253,0.00001493897,5.102851e-7,0.00000219908],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.02888063,"threshold_uncertainty_score":0.1945874,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02719361798379256,"score_gpt":0.2473469636182241,"score_spread":0.2201533456344316,"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."}}