{"id":"W2605119646","doi":"10.1002/dta.2200","title":"Identification of pyrolysis products of the new psychoactive substance 2‐amino‐1‐(4‐bromo‐2,5‐dimethoxyphenyl)ethanone hydrochloride (<i>bk</i>‐2C‐B) and its iodo analogue <i>bk</i>‐2C‐I","year":2017,"lang":"en","type":"article","venue":"Drug Testing and Analysis","topic":"Free Radicals and Antioxidants","field":"Chemistry","cited_by":9,"is_retracted":false,"has_abstract":true,"ca_institutions":"Trinity College","funders":"National Science Foundation","keywords":"Chemistry; Hydrochloride; Synthetic cannabinoids; Designer drug; Pyrolysis; Medicinal chemistry; Organic chemistry; Pharmacology; Drug; Medicine; Biochemistry","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":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0007156703,0.0003090296,0.0007585617,0.00017455,0.0005380241,0.0001250435,0.0006309623,0.0001213989,0.00002063255],"category_scores_gemma":[0.002006586,0.0002485249,0.0002456851,0.001032947,0.0003749242,0.0002653466,0.000135094,0.0002625501,0.000001617565],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0000218183,"about_ca_system_score_gemma":0.0000710101,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0007832421,"about_ca_topic_score_gemma":0.0001852195,"domain_scores_codex":[0.9975842,0.00007768075,0.0007807741,0.0007537945,0.0004756005,0.0003279582],"domain_scores_gemma":[0.9963316,0.0003873248,0.001576115,0.001210853,0.0003319604,0.0001621968],"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":[0.00002374049,0.0001082638,0.1200519,0.0002452482,0.0007972618,0.000003026993,0.0004576569,0.0001080961,0.8738282,0.00004132698,0.0000760608,0.004259118],"study_design_scores_gemma":[0.0004890304,0.00001181873,0.07633912,0.0002300916,0.00218986,0.000006698762,0.0001339265,0.007349339,0.9123466,0.0005744998,0.00003638422,0.0002926262],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9958681,0.00233043,0.0002384445,0.0005941332,0.00006346644,0.00009762523,0.0001328375,0.00003910869,0.0006358406],"genre_scores_gemma":[0.9966537,0.000300856,0.0009783609,0.00001983805,0.0001484542,0.000007993523,0.00001973501,0.00002678511,0.001844298],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.04371282,"threshold_uncertainty_score":0.9999967,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02269885402929116,"score_gpt":0.2579371437690459,"score_spread":0.2352382897397547,"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."}}