{"id":"W3118701901","doi":"10.1007/s00216-020-02867-3","title":"Trifluoroacetic acid NMR challenge","year":2021,"lang":"en","type":"article","venue":"Analytical and Bioanalytical Chemistry","topic":"Medical Imaging Techniques and Applications","field":"Medicine","cited_by":4,"is_retracted":false,"has_abstract":false,"ca_institutions":"National Research Council Canada","funders":"","keywords":"Trifluoroacetic acid; Chemistry; Analytical Chemistry (journal); Chromatography","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":[0.003015825,0.0006347235,0.0006316325,0.0006514079,0.001212301,0.0007837853,0.001411892,0.002442451,0.01048232],"category_scores_gemma":[0.002429986,0.000368323,0.0003764123,0.0002922381,0.001246713,0.001587373,0.001452076,0.002999016,0.007701305],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0006519402,"about_ca_system_score_gemma":0.001522021,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001497118,"about_ca_topic_score_gemma":0.00185735,"domain_scores_codex":[0.9992263,0.0002254937,0.00003002139,0.0001324454,0.00024196,0.00014374],"domain_scores_gemma":[0.9981641,0.0007144834,0.0001580421,0.0002363295,0.0004732111,0.0002537869],"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":[0.001237127,0.0002500454,0.0004735137,0.001804191,0.0001251929,0.002336322,0.0005017904,0.001925192,0.6772544,0.04966522,0.1236828,0.1407442],"study_design_scores_gemma":[0.0001665385,0.0009965702,0.0008366682,0.0003195803,0.00008178481,0.006109625,0.0007369776,0.002882371,0.3013925,0.03079578,0.6555728,0.0001087977],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"methods","genre_gemma":"empirical","genre_scores_codex":[0.1973428,0.05266811,0.3993865,0.16951,0.01800897,0.0008556695,0.004492662,0.002935362,0.1548],"genre_scores_gemma":[0.4877631,0.07643411,0.2147031,0.08953266,0.01824869,0.001640019,0.007343344,0.001266335,0.1030686],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.01048232,"threshold_uncertainty_score":0.03506684,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02563635186868951,"score_gpt":0.3021355090233911,"score_spread":0.2764991571547016,"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."}}