{"id":"W2024010901","doi":"10.1139/v00-172","title":"Thermodynamic of metal complexation of the macrocyclic antibiotic rifampicin","year":2001,"lang":"en","type":"article","venue":"Canadian Journal of Chemistry","topic":"Chemical and Physical Properties in Aqueous Solutions","field":"Chemical Engineering","cited_by":8,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"","keywords":"Chemistry; Enthalpy; Gibbs free energy; Protonation; Ionic strength; Equilibrium constant; Stability constants of complexes; Ionic bonding; Stoichiometry; Metal; Inorganic chemistry; Physical chemistry; Thermodynamics; Ion; Aqueous solution; Organic chemistry","routes":{"ca_aff":false,"ca_fund":false,"ca_venue":true,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00005735728,0.00008630862,0.0002112735,0.00001946809,0.00003837908,0.000004178497,0.0003321354,0.0000691703,0.0002527492],"category_scores_gemma":[0.0001525154,0.00006081592,0.0001820714,0.0001646929,0.0002071867,0.0000355126,0.00001785839,0.0002570827,0.000001418463],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00009967664,"about_ca_system_score_gemma":0.0001734403,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0007989331,"about_ca_topic_score_gemma":0.0001561401,"domain_scores_codex":[0.9992714,0.00001062013,0.000358092,0.00006231645,0.0001345655,0.0001630098],"domain_scores_gemma":[0.9992755,0.00004567808,0.0002254406,0.0001747372,0.0001154807,0.0001631474],"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":[0.000008517773,0.00002103868,0.0007722151,0.00007427717,0.00004250064,0.000003294747,0.00009396797,0.0006179046,0.9978421,0.00008572617,0.00009708505,0.0003413162],"study_design_scores_gemma":[0.0002491173,0.00001156586,0.0009044387,0.0001791765,0.00004292676,0.00009507195,0.00006659899,0.003370646,0.9936161,0.0007432001,0.0006296296,0.00009153541],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9908736,0.000294306,0.0001982648,0.0001849572,0.00007143786,0.00002801306,0.00002113535,0.000003149072,0.008325129],"genre_scores_gemma":[0.9994889,0.000007365174,0.00005158194,0.00002234054,0.00009736865,1.880282e-7,0.000002664065,0.00001003686,0.0003195796],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.008615267,"threshold_uncertainty_score":0.2767427,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01196092550214507,"score_gpt":0.2022488742836268,"score_spread":0.1902879487814818,"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."}}