{"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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001590542,0.0002622747,0.0003538567,0.00002933402,0.0001569734,0.0001960691,0.000249788,0.0001580773,0.0006433845],"category_scores_gemma":[0.00006578524,0.0001602526,0.0001672339,0.0002403769,0.001041601,0.0001167369,0.0002026683,0.0004399327,0.000004723325],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00006160865,"about_ca_system_score_gemma":0.00004289088,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00003674561,"about_ca_topic_score_gemma":0.000001556207,"domain_scores_codex":[0.9984713,0.000009639417,0.0002907155,0.0005356506,0.0003107207,0.0003819789],"domain_scores_gemma":[0.9991323,0.0001390758,0.00006802718,0.0003664017,0.00003748998,0.0002567049],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"theoretical_or_conceptual","study_design_gemma":"theoretical_or_conceptual","study_design_scores_codex":[0.0009423776,0.0007955744,0.003130405,0.0009591508,0.0007537291,0.0001698843,0.0002720696,0.000008145656,0.1427382,0.8402929,0.0005151235,0.00942251],"study_design_scores_gemma":[0.009052973,0.00009783493,0.0003620637,0.0003700095,0.001589309,0.0003513517,0.0009969376,0.0459374,0.3443001,0.5856156,0.009498188,0.001828228],"study_design_candidate":"theoretical_or_conceptual","study_design_consensus":"theoretical_or_conceptual","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.713747,0.001432215,0.01069788,0.04689029,0.00002041413,0.0003542345,0.0001017437,0.0004622736,0.226294],"genre_scores_gemma":[0.9949422,0.0002887988,0.001255119,0.0001373597,0.0001437509,0.00001858343,0.00001869582,0.00001773259,0.003177692],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.2811953,"threshold_uncertainty_score":0.7044609,"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."}}