{"id":"W2015876664","doi":"10.1529/biophysj.104.052399","title":"2H-NMR Study and Molecular Dynamics Simulation of the Location, Alignment, and Mobility of Pyrene in POPC Bilayers","year":2005,"lang":"en","type":"article","venue":"Biophysical Journal","topic":"Lipid Membrane Structure and Behavior","field":"Biochemistry, Genetics and Molecular Biology","cited_by":122,"is_retracted":false,"has_abstract":false,"ca_institutions":"University of Calgary","funders":"","keywords":"Bilayer; Pyrene; Molecular dynamics; Chemistry; POPC; Chemical physics; NMR spectra database; Lipid bilayer; Monolayer; Deuterium NMR; Molecule; Nuclear magnetic resonance spectroscopy; Crystallography; Membrane; Spectral line; Computational chemistry; Stereochemistry; Physics; Organic chemistry","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":[0.0001607667,0.000223096,0.0002408322,0.0002653196,0.0007720657,0.0003680566,0.0003882343,0.0003425135,0.001684223],"category_scores_gemma":[0.0004714718,0.0002849164,0.000256298,0.0002346664,0.0005337786,0.0006671174,0.0002139424,0.0006237904,0.0001330086],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0008876256,"about_ca_system_score_gemma":0.0006215711,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.01088187,"about_ca_topic_score_gemma":0.004854853,"domain_scores_codex":[0.9999373,0.000008258045,0.000002469952,0.00001143597,0.00001362654,0.00002695712],"domain_scores_gemma":[0.9998314,0.00006141188,0.00002344102,0.00001677942,0.00002903111,0.00003775122],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"simulation_or_modeling","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.001205426,0.0008191047,0.007709431,0.0001800131,0.0001474783,0.0008923245,0.0008669095,0.4859045,0.478052,0.01652663,0.001032127,0.006664113],"study_design_scores_gemma":[0.0001357831,0.0002181294,0.006158439,0.000008139568,0.00002850833,0.00004864386,0.0001874625,0.9374474,0.05440122,0.000735616,0.0005944216,0.00003625611],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9983056,0.00003846656,0.0005622043,0.00007874683,0.000004802429,0.000004527736,0.00004422305,0.00001695614,0.0009445111],"genre_scores_gemma":[0.998875,0.00004730312,0.0006621536,0.00001514122,0.000003186261,0.00000738853,0.00007083994,0.00000954892,0.0003093117],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01088187,"threshold_uncertainty_score":0.02163708,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.006518190722461369,"score_gpt":0.2614231776892877,"score_spread":0.2549049869668264,"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."}}