{"id":"W4398180191","doi":"10.1002/jms.5044","title":"On the fate of protonated chloroformates in the gas phase: a competition between forming HCl and chloroformic acid","year":2024,"lang":"en","type":"article","venue":"Journal of Mass Spectrometry","topic":"Chemical Thermodynamics and Molecular Structure","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Ottawa","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Chemistry; Protonation; Gas phase; Competition (biology); Medicinal chemistry; Organic chemistry","routes":{"ca_aff":true,"ca_fund":true,"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":[0.0003616726,0.0003721565,0.0002657647,0.0003008001,0.000252925,0.0003594636,0.0003629193,0.0004257172,0.002255939],"category_scores_gemma":[0.0004902981,0.0001586297,0.0002100985,0.0001594346,0.0003676169,0.0005446681,0.0003155927,0.0004233006,0.0004608949],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004329715,"about_ca_system_score_gemma":0.0001919034,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001600172,"about_ca_topic_score_gemma":0.001349303,"domain_scores_codex":[0.9998227,0.00002326297,0.000005015496,0.00003945547,0.000055925,0.00005368523],"domain_scores_gemma":[0.9998198,0.00007606459,0.00003508071,0.00001098769,0.00004089313,0.00001725387],"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":[0.001222783,0.00006600376,0.003998995,0.0002576442,0.00003820005,0.0004528761,0.00009511923,0.002770123,0.9850962,0.0009628435,0.000391988,0.004647213],"study_design_scores_gemma":[0.0000399687,0.0004462551,0.007575629,0.0000187451,0.00002235233,0.0001372285,0.0001452773,0.0233907,0.9665664,0.0003196055,0.001311704,0.0000260061],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9947689,0.001119848,0.001418834,0.0001142922,0.00002085341,0.00002002817,0.0003834515,0.00003758558,0.002116245],"genre_scores_gemma":[0.998948,0.0002422539,0.0002807754,0.0000162227,0.000004848002,0.000004915619,0.0001343813,0.000006586803,0.0003620616],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002255939,"threshold_uncertainty_score":0.007546902,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.008988254946517985,"score_gpt":0.2570028632983641,"score_spread":0.2480146083518462,"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."}}