{"id":"W4412654051","doi":"10.1021/acs.molpharmaceut.4c01173","title":"Pharmaceutical Nitrosamines: A Comprehensive Review of Health Risks, Detection, Mitigation Strategies Supplemented with CYP450 Interactions as Molecular Simulations for Mechanistic Insight into Carcinogenicity","year":2025,"lang":"en","type":"review","venue":"Molecular Pharmaceutics","topic":"Carcinogens and Genotoxicity Assessment","field":"Biochemistry, Genetics and Molecular Biology","cited_by":4,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"","keywords":"Nitrosamine; Chemistry; Carcinogen; Cytochrome P450; Biochemical engineering; Drug; Computational biology; Environmental chemistry; Pharmacology; Biochemistry; Enzyme; Medicine; Biology","routes":{"ca_aff":false,"ca_fund":false,"ca_venue":false,"about_ca":true,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0005629993,0.001305995,0.001357089,0.001118999,0.0003225204,0.0008308063,0.000724803,0.001042413,0.003246667],"category_scores_gemma":[0.0007231651,0.0005043059,0.001628106,0.001331802,0.0002651449,0.001151106,0.0005507331,0.001091757,0.0009399206],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005463317,"about_ca_system_score_gemma":0.0009471297,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.002314771,"about_ca_topic_score_gemma":0.002712401,"domain_scores_codex":[0.9997348,0.00006545512,0.00003019992,0.00004299821,0.0001009129,0.00002558236],"domain_scores_gemma":[0.9997166,0.0001572914,0.0000480804,0.00001296269,0.00005248157,0.00001269609],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"design_other","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.0002409258,0.0003697521,0.001568955,0.08338819,0.0009624815,0.0007177243,0.0003055837,0.05671847,0.02821095,0.03889475,0.04323692,0.7453853],"study_design_scores_gemma":[0.00004282503,0.0006932345,0.001914628,0.006567955,0.0009780144,0.001012239,0.0001500715,0.02235168,0.01248661,0.0134434,0.9402252,0.0001342627],"study_design_candidate":"simulation_or_modeling","study_design_consensus":null,"genre_codex":"review","genre_gemma":"review","genre_scores_codex":[0.002792791,0.9862007,0.006433421,0.0006815302,0.0002345225,0.00003794238,0.0002333623,0.00009530948,0.003290313],"genre_scores_gemma":[0.0114998,0.9829614,0.003394591,0.0002786798,0.000191583,0.00004978469,0.0002215617,0.00002092037,0.001381688],"genre_candidate":"review","genre_consensus":"review","teacher_disagreement_score":0.003246667,"threshold_uncertainty_score":0.01086116,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.06227508946697904,"score_gpt":0.4523368999733458,"score_spread":0.3900618105063668,"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."}}