{"id":"W2950047918","doi":"10.1016/j.molliq.2019.111195","title":"Solubility and thermodynamics of probenecid-4,4′-azopyridine cocrystal in pure and binary solvents","year":2019,"lang":"en","type":"article","venue":"Journal of Molecular Liquids","topic":"Crystallization and Solubility Studies","field":"Materials Science","cited_by":17,"is_retracted":false,"has_abstract":false,"ca_institutions":"","funders":"National Natural Science Foundation of China; CNIB","keywords":"Solubility; Non-random two-liquid model; Cocrystal; Chemistry; Dissolution; Gibbs free energy; Enthalpy; Acetonitrile; Gravimetric analysis; Powder diffraction; Thermodynamics; Physical chemistry; Organic chemistry; Crystallography; Activity coefficient; Hydrogen bond; Aqueous solution","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000338758,0.0002631083,0.0004734798,0.000337878,0.0004128143,0.0005918561,0.0005828503,0.0002120582,0.002538009],"category_scores_gemma":[0.001042674,0.0001949802,0.0001607954,0.0005956712,0.00051005,0.0005073146,0.0002022127,0.0004721124,0.0004023185],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001152385,"about_ca_system_score_gemma":0.0007809186,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.01234763,"about_ca_topic_score_gemma":0.006746715,"domain_scores_codex":[0.9996154,0.00005366519,0.00003087145,0.0001020813,0.0001228912,0.00007512069],"domain_scores_gemma":[0.9996309,0.0002027252,0.00004546253,0.00001444462,0.00008157876,0.00002472674],"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":[0.0009873492,0.00009963669,0.001551651,0.0003171047,0.00004622688,0.0002522811,0.0003246141,0.004280736,0.9809517,0.003148116,0.001051197,0.006989582],"study_design_scores_gemma":[0.00002327373,0.0001968642,0.001927213,0.00001261621,0.00001990472,0.00008709959,0.00007125558,0.01258762,0.9833564,0.0001276772,0.001563173,0.00002685745],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9925663,0.001652896,0.001320207,0.00008532083,0.00002624168,0.00001389458,0.000842521,0.00006011795,0.003432384],"genre_scores_gemma":[0.9963616,0.0006557686,0.0008675951,0.00001901785,0.00001107663,0.00002140213,0.0006788538,0.00003163869,0.001353049],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01234763,"threshold_uncertainty_score":0.02455151,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.00746235443760944,"score_gpt":0.241024391957897,"score_spread":0.2335620375202876,"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."}}