{"id":"W1989359347","doi":"10.1007/s00216-004-2826-4","title":"Modern drug discovery and the progression toward a universal mass spectrometer","year":2004,"lang":"en","type":"article","venue":"Analytical and Bioanalytical Chemistry","topic":"Mass Spectrometry Techniques and Applications","field":"Chemistry","cited_by":4,"is_retracted":false,"has_abstract":false,"ca_institutions":"National Research Council Canada","funders":"","keywords":"Mass spectrometry; Drug discovery; Analytical Chemistry (journal); Chemistry; Nanotechnology; Chromatography; Materials science","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":[0.01250039,0.0008845031,0.00169278,0.00204145,0.0008628668,0.002727288,0.002460923,0.003173206,0.003852885],"category_scores_gemma":[0.008295971,0.0005419434,0.0009170879,0.00118319,0.006891834,0.008618631,0.004739135,0.005615708,0.001383555],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00262284,"about_ca_system_score_gemma":0.002738948,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006715693,"about_ca_topic_score_gemma":0.000654458,"domain_scores_codex":[0.9950992,0.001658084,0.0001969926,0.0009024451,0.001848611,0.0002945498],"domain_scores_gemma":[0.9941483,0.002919781,0.0004764372,0.0006688007,0.001290653,0.0004959896],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"theoretical_or_conceptual","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0007432716,0.0003862664,0.00184645,0.001440905,0.0001185454,0.000166334,0.0004059162,0.001905622,0.05857604,0.5486553,0.01660728,0.3691481],"study_design_scores_gemma":[0.0001657711,0.001556823,0.001930809,0.0006674429,0.0001131974,0.001739579,0.0003255476,0.01567013,0.06825414,0.4321382,0.4772314,0.00020703],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"methods","genre_gemma":"empirical","genre_scores_codex":[0.03472259,0.2839752,0.5755934,0.06923649,0.005436045,0.0002723076,0.000415898,0.001891695,0.02845632],"genre_scores_gemma":[0.2245868,0.1459919,0.575847,0.02833473,0.007221629,0.0004170546,0.0004112628,0.0003293829,0.01686016],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.01250039,"threshold_uncertainty_score":0.06610918,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.008349820692459507,"score_gpt":0.2438739321084357,"score_spread":0.2355241114159762,"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."}}