{"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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001069568,0.0001425881,0.0001329216,0.0002064054,0.0001991372,0.0001047494,0.0002049477,0.0002927252,0.001869329],"category_scores_gemma":[0.0001428016,0.00005933215,0.0001154463,0.000135535,0.0001782771,0.000182667,0.0001564374,0.0002523996,0.0001749264],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00008624086,"about_ca_system_score_gemma":0.00009052746,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005539881,"about_ca_topic_score_gemma":0.0006570015,"domain_scores_codex":[0.9998943,0.00001291253,0.000003208072,0.00001719023,0.00005427689,0.00001819422],"domain_scores_gemma":[0.999927,0.00002544939,0.00001260719,0.000003708602,0.00002230207,0.000008885153],"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":[0.00007946901,0.00001630185,0.0002456035,0.00003075923,0.000002694256,0.00003873723,0.00004305773,0.0001501699,0.9969398,0.0001006625,0.00004380951,0.002308802],"study_design_scores_gemma":[0.000007106702,0.0003794858,0.00722144,0.000008803519,0.000008386368,0.0001011134,0.0001561764,0.005276971,0.9853596,0.0001214001,0.001347553,0.0000118018],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9942321,0.000683927,0.002566723,0.0001062434,0.00002124588,0.00001437373,0.0001000877,0.00001865788,0.002256479],"genre_scores_gemma":[0.9957059,0.0003702069,0.001652278,0.00008449163,0.00001074387,0.0000100979,0.0001417791,0.000005921961,0.002018485],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001869329,"threshold_uncertainty_score":0.006253481,"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."}}