{"id":"W4394142932","doi":"10.6084/m9.figshare.14191374","title":"Insights into the interaction dynamics between volatile anesthetics and tubulin through computational molecular modelling","year":2021,"lang":"en","type":"dataset","venue":"Figshare","topic":"Free Radicals and Antioxidants","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Alberta","funders":"","keywords":"Volatile anesthetic; Molecular dynamics; Tubulin; Computational biology; Chemistry; Computer science; Biology; Computational chemistry; Microtubule; Genetics; 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":[0.0005273872,0.001323902,0.0009537039,0.0009362164,0.000550774,0.0009262776,0.002403733,0.001790108,0.007298469],"category_scores_gemma":[0.001942449,0.0004355685,0.00159921,0.00126908,0.0003153782,0.0006137363,0.0006821328,0.001497758,0.002702515],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001151067,"about_ca_system_score_gemma":0.001329073,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.02113704,"about_ca_topic_score_gemma":0.04069826,"domain_scores_codex":[0.9998166,0.00006356202,0.0000142083,0.00005155829,0.00003170114,0.00002245738],"domain_scores_gemma":[0.9995005,0.0003290985,0.0000320867,0.00004915546,0.00005740983,0.00003170037],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"simulation_or_modeling","study_design_gemma":"not_applicable","study_design_scores_codex":[0.001097638,0.000495718,0.01130468,0.00530759,0.001043805,0.0005747058,0.0001665761,0.6374876,0.00344717,0.01064588,0.2993003,0.02912835],"study_design_scores_gemma":[0.002068982,0.0003574489,0.01282312,0.0005013965,0.0003427096,0.0002485399,0.0002301733,0.6899173,0.003373535,0.02335825,0.2666195,0.0001590659],"study_design_candidate":"not_applicable","study_design_consensus":null,"genre_codex":"dataset","genre_gemma":"dataset","genre_scores_codex":[0.1638288,0.00755812,0.008662585,0.004144151,0.0004072479,0.0002585073,0.7976575,0.004787738,0.01269532],"genre_scores_gemma":[0.1914101,0.002531896,0.01984386,0.0005698741,0.00006445789,0.0008220929,0.7802197,0.0004685976,0.004069441],"genre_candidate":"dataset","genre_consensus":"dataset","teacher_disagreement_score":0.02113704,"threshold_uncertainty_score":0.04202801,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02790431538972338,"score_gpt":0.2649586362165052,"score_spread":0.2370543208267818,"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."}}