{"id":"W4414382101","doi":"10.1002/jssc.70283","title":"Determination of Solute Descriptors for the Solvation Parameter Model by Reversed‐Phase Liquid Chromatography Binary and Ternary Solvent Systems: A Case Study","year":2025,"lang":"en","type":"article","venue":"Journal of Separation Science","topic":"Analytical Chemistry and Chromatography","field":"Chemistry","cited_by":1,"is_retracted":false,"has_abstract":true,"ca_institutions":"CanAm Bioresearch (Canada)","funders":"","keywords":"Solvation; Ternary operation; Binary number; Solvent; Replicate; Activity coefficient; Gas chromatography; Volume (thermodynamics)","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":[0.0008562824,0.0001205165,0.0002162155,0.0001932517,0.0003151982,0.0001036253,0.0002498183,0.00005886487,0.000005464818],"category_scores_gemma":[0.0001281718,0.00008700405,0.0001225969,0.0004933511,0.0003360683,0.0005558715,0.00004364934,0.0001172929,7.783431e-8],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0000495594,"about_ca_system_score_gemma":0.0001547831,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001452931,"about_ca_topic_score_gemma":0.000001586615,"domain_scores_codex":[0.9985847,0.00001900284,0.0006487017,0.0001940504,0.000404248,0.0001492752],"domain_scores_gemma":[0.9985054,0.0002104613,0.00056632,0.0001951672,0.0004466698,0.00007598783],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.0004770569,0.0009117287,0.001392409,0.000355451,0.0001300417,0.00005976059,0.001686819,0.00156541,0.9910473,0.0001065519,0.001576949,0.0006905094],"study_design_scores_gemma":[0.002141221,0.0007751452,0.00003760317,0.0002532026,0.0004061579,0.0005142213,0.008561827,0.8388454,0.1478604,0.0002304026,0.0001873694,0.000187038],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8626099,0.0003694276,0.1366081,0.00007383329,0.00007654465,0.000166523,0.00001401675,0.000006884844,0.00007469805],"genre_scores_gemma":[0.9989154,0.00003945503,0.0008658267,0.00003110641,0.00002724606,0.00002058486,0.000001768163,0.000004535425,0.00009401393],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.8431869,"threshold_uncertainty_score":0.3547922,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02935467613280368,"score_gpt":0.3456533885059908,"score_spread":0.3162987123731871,"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."}}