{"id":"W4414579335","doi":"10.1016/j.jinorgbio.2025.113083","title":"Intercalative binding, light-switch behavior, and theoretical analysis of Ru(bpy)2dppz-BTDZ]2+: A thiadiazole-extended ruthenium(II) complex","year":2025,"lang":"en","type":"article","venue":"Journal of Inorganic Biochemistry","topic":"Ferrocene Chemistry and Applications","field":"Chemistry","cited_by":1,"is_retracted":false,"has_abstract":false,"ca_institutions":"Institut National de la Recherche Scientifique","funders":"Universidade Federal Fluminense; Fundação Carlos Chagas Filho de Amparo à Pesquisa do Estado do Rio de Janeiro; Conselho Nacional de Desenvolvimento Científico e Tecnológico","keywords":"Intercalation (chemistry); Ethidium bromide; Quenching (fluorescence); Excited state; DNA; Binding constant; Binding energy; Molecular dynamics","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":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow","insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0002545459,0.0003339927,0.0007788588,0.0002076582,0.0001782762,0.00004922299,0.0006574112,0.0004132715,0.002055364],"category_scores_gemma":[0.0002304038,0.0002989671,0.0004130239,0.0009851607,0.0004654294,0.000078278,0.0002890859,0.0007454681,0.000002162341],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000159505,"about_ca_system_score_gemma":0.0002483649,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000004252334,"about_ca_topic_score_gemma":0.000001150114,"domain_scores_codex":[0.9978738,0.00001960836,0.001070517,0.0003816085,0.0003488097,0.0003056806],"domain_scores_gemma":[0.9978859,0.0001620202,0.0007607764,0.0005435525,0.0004185709,0.0002291829],"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":[0.0001058526,0.000506418,0.006372393,0.0002249439,0.001308083,0.0000111575,0.0003522463,0.000002007564,0.9882452,0.001583988,0.0009293571,0.0003583518],"study_design_scores_gemma":[0.0007714367,0.00003227523,0.002675714,0.0002096962,0.002478821,0.00008837029,0.0009041398,0.0001859735,0.991268,0.000793273,0.0003365542,0.000255737],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9882534,0.0004437095,0.0002478755,0.0009276094,0.00003960274,0.00005010537,0.0001046778,0.00002724418,0.009905742],"genre_scores_gemma":[0.9983765,0.00009309922,0.0003734937,0.00007954908,0.0001043219,0.00000901849,0.00006062886,0.00002165483,0.0008817075],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01012309,"threshold_uncertainty_score":0.9999462,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.008446005424112406,"score_gpt":0.2686157101751976,"score_spread":0.2601697047510852,"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."}}