{"id":"W1984730505","doi":"10.1021/ol0069148","title":"Selective Binding of <i>cis</i>-1,3,5-Cyclohexane Tricarboxylic Acid vs Its Epimeric <i>trans </i>Isomer by a Tripodal Amidopyridine Receptor; Crystal Structures of the 1:1 Complexes","year":2000,"lang":"en","type":"article","venue":"Organic Letters","topic":"Molecular Sensors and Ion Detection","field":"Chemistry","cited_by":8,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of New Brunswick","funders":"","keywords":"Chemistry; Epimer; Cyclohexane; Tricarboxylic acid; Selectivity; Stereochemistry; Crystal structure; Crystallography; Catalysis; Citric acid cycle; Organic chemistry; Metabolism; Biochemistry","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00008807687,0.0002644031,0.0003936212,0.000102494,0.0001884475,0.000671568,0.0006294028,0.0003201978,0.001224146],"category_scores_gemma":[0.0001906591,0.000201535,0.000117651,0.0001366372,0.0002772913,0.0001627431,0.0001560761,0.0005120975,0.0003725029],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0008104641,"about_ca_system_score_gemma":0.0002658305,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.004255734,"about_ca_topic_score_gemma":0.00345471,"domain_scores_codex":[0.9998642,0.00001042535,0.000005079457,0.00003968588,0.00004320208,0.00003741895],"domain_scores_gemma":[0.9999313,0.00001171267,0.00001819916,0.000003870832,0.000007807932,0.00002698526],"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":[0.0003227701,0.00002472076,0.0001918284,0.00007104364,0.00001365532,0.00006132865,0.00003694222,0.0002870588,0.9972774,0.0002313392,0.0003628843,0.001118897],"study_design_scores_gemma":[0.00009339995,0.0001878214,0.002251435,0.00000701051,0.00001996244,0.0002135228,0.00006131695,0.002960464,0.9912505,0.00004000295,0.002899571,0.00001509204],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9939183,0.00108964,0.00121817,0.0001101509,0.00002583926,0.00002411568,0.0002849195,0.0001126613,0.003216148],"genre_scores_gemma":[0.995124,0.0007298616,0.001656514,0.00006474764,0.000008487772,0.00003012579,0.0004708864,0.00003305876,0.001882288],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004255734,"threshold_uncertainty_score":0.008461952,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.004553991705396129,"score_gpt":0.1858112432323488,"score_spread":0.1812572515269527,"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."}}