{"id":"W2014748510","doi":"10.1002/dta.8","title":"Vibrational spectroscopic study of salbutamol hemisulphate","year":2009,"lang":"en","type":"article","venue":"Drug Testing and Analysis","topic":"Pharmacological Effects and Assays","field":"Agricultural and Biological Sciences","cited_by":25,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"World Anti-Doping Agency","keywords":"Salbutamol; Raman spectroscopy; Infrared; Chemistry; Infrared spectroscopy; Molecule; Fourier transform infrared spectroscopy; Molecular vibration; Computational chemistry; Analytical Chemistry (journal); Physical chemistry; Organic chemistry; Physics; Medicine; Optics; Asthma","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001712363,0.00007543538,0.0001906867,0.00001690119,0.0001226709,0.00002970289,0.00007788275,0.00001658956,0.0001051345],"category_scores_gemma":[0.00008920842,0.00002693404,0.00005262209,0.0007920463,0.00001730472,0.0000398803,0.00001971941,0.00005274903,0.000001386659],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000003768525,"about_ca_system_score_gemma":0.000001865631,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001422168,"about_ca_topic_score_gemma":0.00002873605,"domain_scores_codex":[0.999379,0.0000559437,0.000147705,0.0001809691,0.0001215075,0.0001148906],"domain_scores_gemma":[0.9994745,0.0003339328,0.00007558297,0.00002430049,0.00003587505,0.00005584315],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"observational","study_design_scores_codex":[0.000007112112,0.0004625285,0.2614128,0.000002090283,0.00009067879,0.000005403279,0.0000633148,0.0001654621,0.7018787,0.00002733536,0.00003996455,0.03584458],"study_design_scores_gemma":[0.0001513292,0.0004428297,0.9864625,0.00000505626,0.000253061,5.345876e-7,0.000154745,0.006110785,0.005781898,0.0005315006,0.00001182676,0.00009390331],"study_design_candidate":"observational","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9988417,0.00004592165,0.000008462591,0.0003303417,0.000006770224,0.00006877005,0.000004968064,0.00003442106,0.0006586267],"genre_scores_gemma":[0.9995356,0.000003438452,0.0002308025,0.0001131457,0.00005825525,0.000002181685,0.000009601731,1.721638e-7,0.0000468669],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.7250497,"threshold_uncertainty_score":0.1151149,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02167832498373209,"score_gpt":0.2656060010286356,"score_spread":0.2439276760449035,"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."}}