{"id":"W3189564079","doi":"10.1039/d1ra05711a","title":"Deuterium equilibrium isotope effects in a supramolecular receptor for the hydrochalcogenide and halide anions","year":2021,"lang":"en","type":"article","venue":"RSC Advances","topic":"Sulfur Compounds in Biology","field":"Biochemistry, Genetics and Molecular Biology","cited_by":1,"is_retracted":false,"has_abstract":true,"ca_institutions":"Impact","funders":"Division of Chemistry; National Institute of General Medical Sciences; University of Oregon; National Institutes of Health; National Science Foundation","keywords":"Halide; Deuterium; Supramolecular chemistry; Chemistry; Kinetic isotope effect; Isotope; Stable isotope ratio; Inorganic chemistry; Radiochemistry; Molecule; Organic chemistry; Physics; Atomic physics; Nuclear 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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0003114675,0.0002292154,0.0002613906,0.00007760364,0.0001695644,0.0002924541,0.0004407516,0.0002668822,0.001668891],"category_scores_gemma":[0.0002114017,0.0001249216,0.0001396784,0.0000765785,0.0004357105,0.0003235697,0.0003695812,0.0006731328,0.0003814279],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003606066,"about_ca_system_score_gemma":0.0001823372,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005699706,"about_ca_topic_score_gemma":0.0009834779,"domain_scores_codex":[0.9998839,0.00001230025,0.000006078344,0.00002930765,0.00003978803,0.00002862781],"domain_scores_gemma":[0.9999155,0.00002790322,0.00001686829,0.00001230583,0.00001028367,0.00001709531],"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":[0.00008625833,0.00001736899,0.00008568841,0.00007902091,0.000004115299,0.00006186838,0.00003886466,0.000168266,0.9962733,0.00115369,0.0001298944,0.001901794],"study_design_scores_gemma":[0.000008370687,0.0001154313,0.000123865,0.000002201053,0.000003441324,0.00006758716,0.00001857217,0.0008677318,0.996767,0.00008604385,0.00193371,0.000006071903],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9777329,0.001308358,0.01399135,0.0005169737,0.0000985451,0.00005377389,0.0001781466,0.0002596674,0.005860363],"genre_scores_gemma":[0.9925267,0.0004942785,0.004720327,0.0001672734,0.00001653676,0.00002627116,0.00008450352,0.00002953948,0.00193463],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001668891,"threshold_uncertainty_score":0.005583048,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.009483494397336973,"score_gpt":0.2682183235176477,"score_spread":0.2587348291203107,"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."}}