{"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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001436162,0.0003730836,0.0001461311,0.0003371618,0.0001522707,0.0001499386,0.0001544899,0.0004120533,0.001198526],"category_scores_gemma":[0.0002488918,0.0001684348,0.0002616459,0.0001828686,0.0002721222,0.0002696292,0.0001887687,0.0005257737,0.0003442844],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001333353,"about_ca_system_score_gemma":0.0001706193,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004216356,"about_ca_topic_score_gemma":0.0006409837,"domain_scores_codex":[0.9998418,0.00001548684,0.000005463879,0.00004814971,0.00006571539,0.00002335317],"domain_scores_gemma":[0.9998171,0.00004063554,0.00006031918,0.0000166248,0.00004261807,0.00002268206],"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":[0.00007359844,0.00000773603,0.0003556694,0.0000432807,0.000004488665,0.00009037168,0.00002186348,0.00004170982,0.9981279,0.000034951,0.00001558792,0.001182817],"study_design_scores_gemma":[0.00000457951,0.0002343111,0.0059426,0.00001150784,0.00001096612,0.0004538377,0.0000481826,0.0004922529,0.991607,0.00003398962,0.001153643,0.000007165639],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.981384,0.002800024,0.01231408,0.00004562883,0.00004141696,0.00007590542,0.000623238,0.00006250798,0.002653179],"genre_scores_gemma":[0.9822373,0.001636246,0.01243189,0.00006661416,0.00001324368,0.00006828302,0.0005571283,0.00002984869,0.002959497],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001198526,"threshold_uncertainty_score":0.004009485,"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."}}