{"id":"W4412772451","doi":"10.1021/acsbiomedchemau.5c00014","title":"Thermodynamic Coupling between Folding Correctors and the First of Dimerized Nucleotide Binding Domains in CFTR","year":2025,"lang":"en","type":"article","venue":"ACS Bio & Med Chem Au","topic":"Cystic Fibrosis Research Advances","field":"Medicine","cited_by":13,"is_retracted":false,"has_abstract":true,"ca_institutions":"Centre for Drug Research and Development","funders":"National Institute of Diabetes and Digestive and Kidney Diseases; American Heart Association","keywords":"Folding (DSP implementation); Nucleotide; Coupling (piping); Protein folding; Chemistry; Biophysics; Crystallography; Chemical physics; Computational biology; Biology; Materials science; Biochemistry; Engineering","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":[0.0002312155,0.0003434902,0.0004382636,0.000189687,0.0006181285,0.0003985378,0.0004427029,0.0003414433,0.002146415],"category_scores_gemma":[0.0005428766,0.00026248,0.000387247,0.0001284048,0.0004093503,0.0007673538,0.0004620227,0.0003181569,0.0001988592],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005805112,"about_ca_system_score_gemma":0.0006912773,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.003880388,"about_ca_topic_score_gemma":0.005163906,"domain_scores_codex":[0.9999049,0.00001556081,0.000004904961,0.00002282282,0.00002111398,0.00003077772],"domain_scores_gemma":[0.9999247,0.00001867434,0.00001640772,0.000009188656,0.00001229702,0.00001880143],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"simulation_or_modeling","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0007888296,0.0003752871,0.02205341,0.000512819,0.0002095521,0.0008028681,0.0003353801,0.7363048,0.1912016,0.01678499,0.001055925,0.02957456],"study_design_scores_gemma":[0.00006800467,0.0003943256,0.009207319,0.00002676483,0.00009743727,0.0001577204,0.0001553433,0.9551314,0.0276699,0.005185911,0.001861277,0.000044494],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9842849,0.0003351817,0.01229864,0.00009813819,0.00002724931,0.00002067321,0.00007231007,0.00007788687,0.002785011],"genre_scores_gemma":[0.9975283,0.0001644103,0.001636245,0.0000359797,0.000004355972,0.00002701721,0.0001026697,0.00002611869,0.00047491],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003880388,"threshold_uncertainty_score":0.007715583,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01072398750510497,"score_gpt":0.2893876764754565,"score_spread":0.2786636889703515,"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."}}