{"id":"W3156835628","doi":"10.1039/d1nj01491a","title":"Heteroleptic enantiopure Pd(<scp>ii</scp>)-complexes derived from halogen-substituted Schiff bases and 2-picolylamine: synthesis, experimental and computational characterization and investigation of the influence of chirality and halogen atoms on the anticancer activity","year":2021,"lang":"en","type":"article","venue":"New Journal of Chemistry","topic":"Metal complexes synthesis and properties","field":"Medicine","cited_by":17,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Winnipeg; University of Manitoba","funders":"Fundação para a Ciência e a Tecnologia; University of Isfahan","keywords":"Chemistry; Enantiopure drug; Halogen; Chirality (physics); Characterization (materials science); Combinatorial chemistry; Polymer chemistry; Stereochemistry; Enantioselective synthesis; Organic chemistry; Nanotechnology; Catalysis","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":[0.00008589444,0.0002585097,0.0002526606,0.0001877734,0.0001355014,0.0004179225,0.000451151,0.000220656,0.001177332],"category_scores_gemma":[0.0001869092,0.0001840013,0.0001341223,0.0002305779,0.000158558,0.00018102,0.0002306864,0.0003101238,0.0003270859],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000308581,"about_ca_system_score_gemma":0.0001825129,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006494119,"about_ca_topic_score_gemma":0.001118918,"domain_scores_codex":[0.9999279,0.000007596105,0.000005009823,0.00001977907,0.00002601506,0.00001378814],"domain_scores_gemma":[0.9999627,0.000004919833,0.000009922294,0.000007276966,0.0000079947,0.000007238883],"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":[0.000913432,0.0001366772,0.001534769,0.0006364501,0.0001034649,0.0002761834,0.00007359439,0.007362659,0.9596086,0.003975722,0.0009879724,0.02439053],"study_design_scores_gemma":[0.00005986154,0.0002870749,0.0009821865,0.000007069201,0.00004771827,0.0002216655,0.00003173954,0.009426838,0.9818365,0.0002257057,0.006860048,0.00001356066],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9840001,0.001110222,0.006692725,0.00005587958,0.00001984112,0.00006125429,0.0004061623,0.0001403852,0.007513452],"genre_scores_gemma":[0.9941683,0.0003956744,0.003914368,0.00002204236,0.000002243552,0.00002291712,0.0003374858,0.00002646001,0.001110571],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001177332,"threshold_uncertainty_score":0.003938615,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0240460458071116,"score_gpt":0.2384666475537782,"score_spread":0.2144206017466667,"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."}}