{"id":"W4230459331","doi":"10.1002/ange.202103327","title":"Direct Synthesis of Ketones from Methyl Esters by Nickel‐Catalyzed Suzuki–Miyaura Coupling","year":2021,"lang":"en","type":"article","venue":"Angewandte Chemie","topic":"Catalytic Cross-Coupling Reactions","field":"Chemistry","cited_by":12,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Ottawa","funders":"Fundamental Research Funds for the Central Universities; National Natural Science Foundation of China; Canada Foundation for Innovation; State Key Laboratory of Clean Energy Utilization; BASF","keywords":"Chemoselectivity; Chemistry; Aryl; Reactivity (psychology); Catalysis; Nucleophile; Alkyl; Catalytic cycle; Carbene; Ether; Amide; Bond cleavage; Coupling reaction; Nickel; Combinatorial chemistry; Ligand (biochemistry); Functional group; Ketone; Medicinal 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":[0.0002868136,0.0007059419,0.0003475943,0.0003867174,0.0003472382,0.0002986165,0.0003730488,0.0002208176,0.004869429],"category_scores_gemma":[0.0002215667,0.0002769035,0.0002845692,0.000341665,0.0002116461,0.0004344688,0.0005565754,0.0006521412,0.002696697],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002762174,"about_ca_system_score_gemma":0.0005476713,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0008664383,"about_ca_topic_score_gemma":0.002325692,"domain_scores_codex":[0.9998469,0.00002099109,0.00002048943,0.00002109024,0.00003198846,0.00005856846],"domain_scores_gemma":[0.9999171,0.000009303443,0.00001064956,0.00001282971,0.00002097704,0.0000291758],"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":[0.0002953077,0.00009974487,0.0004053034,0.0007424836,0.00006100853,0.001138119,0.0003883658,0.001245565,0.9645081,0.006576914,0.001509878,0.02302918],"study_design_scores_gemma":[0.00004694142,0.0003983352,0.0009502036,0.00003944846,0.00003460194,0.000403485,0.00007922352,0.0008805152,0.9734926,0.0005442562,0.0230913,0.0000392135],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8259596,0.008690422,0.05971244,0.0006068313,0.0008153924,0.0005932288,0.003157186,0.0007059686,0.09975903],"genre_scores_gemma":[0.9613655,0.006424526,0.01724506,0.00009601888,0.00004613006,0.0001426424,0.0006919556,0.00008522635,0.01390289],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004869429,"threshold_uncertainty_score":0.01628989,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01493750272631979,"score_gpt":0.2549780510840961,"score_spread":0.2400405483577763,"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."}}