{"id":"W3166374108","doi":"10.1096/fasebj.2021.35.s1.02331","title":"Atomistic Study of Several Peptides Covering Single‐walled Carbon Nanotube by Noncovalent Adsorption","year":2021,"lang":"en","type":"article","venue":"The FASEB Journal","topic":"Supramolecular Self-Assembly in Materials","field":"Materials Science","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"Memorial University of Newfoundland","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Carbon nanotube; Biomolecule; Nanotechnology; van der Waals force; Drug delivery; Amphiphile; Adsorption; Covalent bond; Rational design; Materials science; Biosensor; Polymer; Surface modification; Molecular dynamics; Chemistry; Molecule; Organic chemistry; Computational chemistry; Copolymer","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":[0.0001017641,0.0002871745,0.000288498,0.0001964046,0.000572814,0.0002351367,0.0004605482,0.0003871905,0.001951592],"category_scores_gemma":[0.0002342173,0.0001842014,0.0003722699,0.0001533953,0.0003370399,0.0004053838,0.0002060803,0.0003494901,0.0001239654],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005723084,"about_ca_system_score_gemma":0.0005154538,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.007918761,"about_ca_topic_score_gemma":0.00611527,"domain_scores_codex":[0.9999455,0.000006744692,0.000001613387,0.00000836603,0.00001650773,0.00002120403],"domain_scores_gemma":[0.9999191,0.00003149464,0.00001334638,0.000007159832,0.00001601279,0.00001291608],"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":[0.0002987604,0.0003300165,0.004756155,0.0002693603,0.0001310062,0.0005995613,0.0001473763,0.8913937,0.08624195,0.009889215,0.0009253825,0.005017543],"study_design_scores_gemma":[0.00002572466,0.0001044023,0.001526347,0.000003958466,0.0000153386,0.00002056846,0.00003405836,0.9924947,0.00504549,0.0004356768,0.0002848317,0.00000878513],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.994046,0.0001154113,0.002257017,0.00008025773,0.00001092798,0.00001255894,0.00009866986,0.00002314209,0.003356106],"genre_scores_gemma":[0.9976801,0.0001013691,0.001468868,0.00002204449,0.000003804915,0.0000191143,0.0001165323,0.00001024531,0.0005779188],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.007918761,"threshold_uncertainty_score":0.01574534,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01651814866437278,"score_gpt":0.2433170943746457,"score_spread":0.226798945710273,"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."}}