{"id":"W2999755199","doi":"10.1016/j.dib.2020.105138","title":"Dataset on interactions of membrane active agents with lipid bilayers","year":2020,"lang":"en","type":"article","venue":"Data in Brief","topic":"Lipid Membrane Structure and Behavior","field":"Biochemistry, Genetics and Molecular Biology","cited_by":3,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Alberta","funders":"Natural Sciences and Engineering Research Council of Canada; King Abdulaziz City for Science and Technology","keywords":"Lipid bilayer; Membrane; In silico; Chemistry; Molecular dynamics; Drug; Biophysics; Computational biology; Biology; Biochemistry; Computational chemistry; Pharmacology","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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00003839662,0.0001031272,0.0001241217,0.00002630161,0.00001838089,0.000008443062,0.0003831946,0.00004503284,0.000113999],"category_scores_gemma":[0.000059935,0.00008334517,0.00001614714,0.0001043722,0.00005013161,0.00001353787,0.0002052487,0.0001069901,0.000007879601],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000004713004,"about_ca_system_score_gemma":0.00004099002,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00008758686,"about_ca_topic_score_gemma":0.0001323799,"domain_scores_codex":[0.999262,0.00002717916,0.0001341557,0.0003589822,0.0001030059,0.0001147109],"domain_scores_gemma":[0.9991747,0.00001010391,0.00006433794,0.0006696357,0.00001818147,0.00006308971],"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":[0.0007380771,0.0001175168,0.0009362042,0.00003563889,0.00005714023,0.00001254763,0.00008669918,0.00003340935,0.9525133,0.000007376966,0.0426312,0.00283083],"study_design_scores_gemma":[0.0006598489,0.000268755,0.002725901,0.00001740652,0.00002926615,0.000007317462,0.00007824689,0.00003140423,0.6750122,2.802825e-7,0.3210574,0.000111992],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9699197,0.000007441333,0.0000491963,0.0006430327,0.0001449742,0.0002078007,0.02840356,0.000005875588,0.0006184523],"genre_scores_gemma":[0.9493976,0.0000277451,0.0001990669,0.001191574,0.000190925,0.000005582211,0.04895258,0.00001228621,0.00002268828],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.2784262,"threshold_uncertainty_score":0.3398717,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.04246548797194655,"score_gpt":0.3090563537733265,"score_spread":0.26659086580138,"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."}}