{"id":"W4415565550","doi":"10.1101/2025.10.25.684567","title":"Quantifying Electrostatic Control of Docking and Binding Energetics in Functional Cx36 Gap Junctions","year":2025,"lang":"","type":"preprint","venue":"bioRxiv (Cold Spring Harbor Laboratory)","topic":"Connexins and lens biology","field":"Biochemistry, Genetics and Molecular Biology","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"Western University","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Docking (animal); Connexin; Gap junction; HEK 293 cells; Macromolecular docking; Electrostatics; Protein–protein interaction","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":[0.0002919846,0.0003149027,0.0003325101,0.0002078704,0.0003022429,0.0004191943,0.0004187213,0.0003121167,0.001493226],"category_scores_gemma":[0.0005192084,0.0001748367,0.000221139,0.0002220987,0.0002888124,0.0005034296,0.000378767,0.0004916656,0.0002047141],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004954929,"about_ca_system_score_gemma":0.0003165102,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001888559,"about_ca_topic_score_gemma":0.001201365,"domain_scores_codex":[0.999885,0.00001512889,0.000007778867,0.00002758353,0.00003369686,0.00003086241],"domain_scores_gemma":[0.9998472,0.00006833401,0.00001980801,0.00001672634,0.00002340703,0.00002462956],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.0007750175,0.0003365131,0.01893612,0.0003032796,0.0001434857,0.0005462056,0.0001864037,0.2827103,0.6772474,0.006468591,0.0007568332,0.01158977],"study_design_scores_gemma":[0.0000564923,0.0002908986,0.01122908,0.00001192386,0.00004295409,0.0001051179,0.0001288003,0.8383235,0.1477028,0.00158183,0.0004826914,0.00004398232],"study_design_candidate":"simulation_or_modeling","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9933259,0.0001396504,0.005488115,0.00002978079,0.00001021473,0.000005196412,0.0001120714,0.00006777279,0.0008213599],"genre_scores_gemma":[0.9988066,0.00005765876,0.0009380748,0.000006026831,0.000001526856,0.000004916883,0.00008573393,0.00001276738,0.0000867079],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001888559,"threshold_uncertainty_score":0.004995286,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01929827009389638,"score_gpt":0.2395621211319654,"score_spread":0.2202638510380691,"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."}}