{"id":"W2947459431","doi":"10.1039/c9cy00561g","title":"H/D exchange in N-heterocycles catalysed by an NHC-supported ruthenium complex","year":2019,"lang":"en","type":"article","venue":"Catalysis Science & Technology","topic":"Chemical Reactions and Isotopes","field":"Pharmacology, Toxicology and Pharmaceutics","cited_by":22,"is_retracted":false,"has_abstract":true,"ca_institutions":"Regional Municipality of Niagara; Brock University","funders":"Natural Sciences and Engineering Research Council of Canada; QEII Foundation","keywords":"Catalysis; Ruthenium; Pyridine; Chemistry; Medicinal chemistry; Combinatorial chemistry; Organic chemistry","routes":{"ca_aff":true,"ca_fund":true,"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":[0.00008870616,0.0001603664,0.0002041017,0.00007882615,0.0001130841,0.0001305682,0.0003591245,0.0002721813,0.0009244912],"category_scores_gemma":[0.0001200264,0.00007886036,0.00008071039,0.00008295177,0.0001998768,0.000171537,0.000209292,0.0002375474,0.0002184563],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001917541,"about_ca_system_score_gemma":0.0001143176,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0009303967,"about_ca_topic_score_gemma":0.001546865,"domain_scores_codex":[0.9999175,0.00001189192,0.000004461562,0.00002194199,0.00002308309,0.00002108969],"domain_scores_gemma":[0.9999626,0.000009900854,0.00001070229,0.000004176714,0.000004015397,0.000008562758],"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":[0.000204193,0.00002521742,0.0001746937,0.00009641819,0.0000102996,0.00008850919,0.00002608511,0.0001562704,0.9941986,0.0002611283,0.0001645556,0.004594023],"study_design_scores_gemma":[0.000009625817,0.00008247036,0.0004100877,0.000002063497,0.000004305959,0.00009963063,0.000006979788,0.0003727275,0.997946,0.00001922192,0.001044133,0.000002744378],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9904761,0.001721748,0.001935844,0.00007268458,0.00002971484,0.00002822366,0.0000891609,0.00008305765,0.005563421],"genre_scores_gemma":[0.9973605,0.0003439723,0.0007709205,0.00002116435,0.000004839014,0.000005131271,0.0000604077,0.00001016025,0.001422828],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0009303967,"threshold_uncertainty_score":0.003092766,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.07560172642702505,"score_gpt":0.4150501491950457,"score_spread":0.3394484227680207,"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."}}