{"id":"W3211531248","doi":"10.1002/etc.5230","title":"In Vivo Transformation of a Novel Polyfluoroether Surfactant","year":2021,"lang":"en","type":"article","venue":"Environmental Toxicology and Chemistry","topic":"Per- and polyfluoroalkyl substances research","field":"Environmental Science","cited_by":10,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Toronto","funders":"Merck KGaA","keywords":"Chemistry; Biotransformation; Metabolite; In vivo; Thioether; Metabolism; Pulmonary surfactant; Kinetics; Urine; In vitro; Biochemistry; Pharmacokinetics; Pharmacology; Stereochemistry; Enzyme; Biology","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":[0.0001444198,0.000316701,0.0001476776,0.0001435551,0.00007001851,0.000196279,0.0001111024,0.0003032638,0.0005639126],"category_scores_gemma":[0.000124717,0.00009795134,0.0002034107,0.00009807826,0.0001030636,0.0001384619,0.00008167806,0.0002853854,0.0001637527],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002049772,"about_ca_system_score_gemma":0.0002136485,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001071136,"about_ca_topic_score_gemma":0.00110104,"domain_scores_codex":[0.9999002,0.00001460744,0.000007046762,0.00003176301,0.00002299505,0.00002340774],"domain_scores_gemma":[0.9998784,0.00002171204,0.00004637629,0.00001467144,0.00001953153,0.00001926749],"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":[0.00008815334,0.00002133826,0.0001140997,0.00000485207,0.000002053449,0.00001742048,0.000005322054,0.00003948869,0.9992152,0.00001172411,0.000006328116,0.0004739631],"study_design_scores_gemma":[0.000004148369,0.0006786161,0.000772031,8.314006e-7,0.00000577451,0.00004437474,0.000006429951,0.0004411278,0.9977638,0.000006832125,0.0002747299,0.000001271499],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9971499,0.0002422061,0.001964248,0.00002294177,0.000009473792,0.00002110918,0.0002097901,0.00002554316,0.000354788],"genre_scores_gemma":[0.9937147,0.0004471585,0.002319482,0.00003270775,0.000006321951,0.00002635036,0.0005211384,0.00001615516,0.002915879],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001071136,"threshold_uncertainty_score":0.002129853,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.009980642609600911,"score_gpt":0.2402069840786153,"score_spread":0.2302263414690144,"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."}}