{"id":"W4392966317","doi":"10.2174/0113852728289791240222054306","title":"Synthesis, Molecular Docking, Anti-cholinesterase Activity, Theoretical Investigation,and Catalytic Effect of New Encumbered N-benzyladamantyl SubstitutedImidazolidin-2-ylidene Carbene Pd-PEPPSI Complexes","year":2024,"lang":"en","type":"article","venue":"Current Organic Chemistry","topic":"Metal complexes synthesis and properties","field":"Medicine","cited_by":2,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Japan Society for the Promotion of Science; Japan Science and Technology Agency; National Institutes of Health; Türkiye Bilimsel ve Teknolojik Araştırma Kurumu; Chinese Academy of Sciences; Ministry of Education, Culture, Sports, Science and Technology; University of Ottawa; National Natural Science Foundation of China; Colorado State University; Natural Sciences and Engineering Research Council of Canada; Alfred P. Sloan Foundation; Engineering and Physical Sciences Research Council; Eli Lilly and Company; Pfizer; Amgen; GlaxoSmithKline; National Key Research and Development Program of China; Camille and Henry Dreyfus Foundation; National Science Foundation","keywords":"Chemistry; Carbene; Docking (animal); Catalysis; Computational chemistry; Stereochemistry; Medicinal chemistry; Organic chemistry","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0003571042,0.0004338393,0.0008228092,0.00008216387,0.00007676466,0.000110952,0.0002117398,0.0001510511,0.0008085259],"category_scores_gemma":[0.0008970171,0.0003362619,0.0001983938,0.0003247398,0.0004676719,0.0001499331,0.0001776614,0.0004095295,0.00002323724],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0000643418,"about_ca_system_score_gemma":0.0003184784,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00004180663,"about_ca_topic_score_gemma":0.00000185208,"domain_scores_codex":[0.9979892,0.00009001674,0.0004887255,0.0006133722,0.0004757884,0.0003429182],"domain_scores_gemma":[0.9983844,0.0004856037,0.0001178959,0.0005527291,0.00008348583,0.0003759513],"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":[0.00009990901,0.00006518844,0.002067428,0.004766135,0.0001798881,0.0000432887,0.0001507141,0.000003941891,0.9882959,0.0006096851,0.000189827,0.003528117],"study_design_scores_gemma":[0.0005239126,0.00005873648,0.001503235,0.002090299,0.0007750175,0.0002990953,0.00001372783,0.0009836705,0.992438,0.0003516329,0.0006468384,0.0003158269],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9832588,0.01507507,0.00008199738,0.0005356086,0.0002728125,0.0003206687,0.00003208088,0.0001335201,0.0002894227],"genre_scores_gemma":[0.9989771,0.0004061893,0.00003635056,0.00002290887,0.0003385738,0.00001904907,0.00006051084,0.00006465607,0.00007465884],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01571828,"threshold_uncertainty_score":0.9999089,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02362209857202177,"score_gpt":0.2871931941287026,"score_spread":0.2635710955566808,"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."}}