{"id":"W4401466592","doi":"10.26434/chemrxiv-2024-wrn9s","title":"T1 T2* Relaxation Time Correlation NMR Monitoring of the Mechanochemical Formation of Quinoxaline Derivatives","year":2024,"lang":"en","type":"preprint","venue":"ChemRxiv","topic":"Synthesis and Biological Evaluation","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of New Brunswick","funders":"","keywords":"Quinoxaline; Benzil; Mechanochemistry; Chemistry; Relaxation (psychology); Work (physics); Nuclear magnetic resonance; Analytical Chemistry (journal); Organic chemistry; Thermodynamics; Physics","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":[0.0003791913,0.0001981276,0.0003094273,0.0000437697,0.00003620557,0.00001755516,0.0002648663,0.0005359917,0.0002561886],"category_scores_gemma":[0.001142919,0.0001343243,0.0002330651,0.000126049,0.00006475641,0.00005138757,0.0004140238,0.0004251974,0.0000187308],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001222168,"about_ca_system_score_gemma":0.00005792759,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000008043485,"about_ca_topic_score_gemma":2.064449e-7,"domain_scores_codex":[0.9985486,0.00004767711,0.0006449011,0.0002828725,0.0003601784,0.0001158307],"domain_scores_gemma":[0.9982999,0.0002876277,0.0007906914,0.0003809282,0.0002156737,0.00002518731],"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":[0.00002276402,0.00004640929,0.001388669,0.0007802862,0.00004056734,9.694719e-8,0.0003013064,0.0003254196,0.9941043,0.0001388439,0.00006086048,0.002790491],"study_design_scores_gemma":[0.000105853,0.000008643159,0.001683487,0.001199533,0.0001116099,0.000001020609,0.00009910412,0.01505129,0.9725464,0.009025893,0.00003426704,0.0001328757],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9959183,0.0004872055,0.0004418257,0.0002142786,0.0002270776,0.0001696942,0.00001211082,0.00005898256,0.002470524],"genre_scores_gemma":[0.9985995,0.00007068466,0.0005835415,0.000003860855,0.0002779473,0.00004235511,0.0001331255,0.00001732804,0.0002716914],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.02155786,"threshold_uncertainty_score":0.5477587,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.03942827828321223,"score_gpt":0.2771208305660893,"score_spread":0.2376925522828771,"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."}}