{"id":"W3006293148","doi":"10.1021/acs.oprd.0c00018","title":"Exploring Homogeneous Conditions for Mild Buchwald–Hartwig Amination in Batch and Flow","year":2020,"lang":"en","type":"article","venue":"Organic Process Research & Development","topic":"Catalytic Cross-Coupling Reactions","field":"Chemistry","cited_by":47,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Ottawa","funders":"Natural Sciences and Engineering Research Council of Canada; Canada Research Chairs; University of Ottawa","keywords":"Amination; Xantphos; Chemistry; Sonogashira coupling; Homogeneous; Functional group; Combinatorial chemistry; Continuous flow; Base (topology); Borylation; Organic chemistry; Catalysis; Palladium; Biochemical engineering; Aryl; Mathematics; Polymer","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":[0.001322554,0.00110037,0.0006644644,0.000550809,0.0005559725,0.0008004832,0.0008640967,0.0007513074,0.00260796],"category_scores_gemma":[0.0009858297,0.0004008124,0.0004354975,0.0005230092,0.0006202692,0.001207691,0.0005681688,0.001418124,0.001413814],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005838241,"about_ca_system_score_gemma":0.0007101796,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001391877,"about_ca_topic_score_gemma":0.003609583,"domain_scores_codex":[0.9992613,0.0001194723,0.00006080248,0.0002539482,0.0001884983,0.0001160867],"domain_scores_gemma":[0.9995465,0.0001609555,0.0001347882,0.00005904436,0.00006160846,0.00003716853],"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":[0.0002070862,0.0002079112,0.0002389023,0.0002790365,0.00002604673,0.00009108098,0.0001012201,0.0006849763,0.9901157,0.0008199439,0.0004226205,0.006805351],"study_design_scores_gemma":[0.0000409612,0.0006652182,0.001020772,0.00002048232,0.00003671139,0.0001419409,0.00005465288,0.001855528,0.9911926,0.0004031287,0.004528045,0.000039806],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.6967295,0.005491687,0.2805546,0.0004273031,0.0002715605,0.001310426,0.002066963,0.001762661,0.01138531],"genre_scores_gemma":[0.8670032,0.004511989,0.1210214,0.0002433092,0.0001587941,0.001202278,0.001592449,0.0003548263,0.00391175],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.00260796,"threshold_uncertainty_score":0.008724511,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.2024937975347083,"score_gpt":0.3768955893017821,"score_spread":0.1744017917670738,"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."}}