{"id":"W2092372160","doi":"10.1017/s0317167100003759","title":"A Mathematical Model for Prediction of Drug Molecule Diffusion Across the Blood-Brain Barrier","year":2004,"lang":"en","type":"article","venue":"Canadian Journal of Neurological Sciences / Journal Canadien des Sciences Neurologiques","topic":"Barrier Structure and Function Studies","field":"Neuroscience","cited_by":13,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Toronto; Dalhousie University","funders":"Natural Sciences and Engineering Research Council of Canada; Queen's University","keywords":"Blood–brain barrier; Cheminformatics; Mathematical model; Computer science; Chemistry; Neuroscience; Mathematics; Computational chemistry; Biology","routes":{"ca_aff":true,"ca_fund":true,"ca_venue":true,"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":[0.001403403,0.0009168337,0.001251269,0.001064818,0.0005520073,0.001270614,0.001643135,0.002313039,0.002638854],"category_scores_gemma":[0.006015972,0.0005151407,0.001373041,0.0007180185,0.001232076,0.002033104,0.0008438432,0.001544146,0.0007081368],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001827912,"about_ca_system_score_gemma":0.001960021,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.008561006,"about_ca_topic_score_gemma":0.003367082,"domain_scores_codex":[0.9995497,0.0001459892,0.00002579571,0.00008137835,0.0001322656,0.00006487843],"domain_scores_gemma":[0.9976836,0.001622498,0.0002501979,0.00005404349,0.0003165574,0.00007292222],"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":[0.00002009397,0.00002133278,0.0004508942,0.00005689218,0.00002175701,0.00007208992,0.0000308592,0.957991,0.0009304241,0.03604846,0.0007071313,0.003649114],"study_design_scores_gemma":[0.000004185767,0.00001097748,0.0000528825,0.000004610464,0.000004929391,0.00001335406,0.000002603757,0.9942297,0.00009186757,0.005230298,0.0003504208,0.000004178344],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"methods","genre_gemma":"methods","genre_scores_codex":[0.02721825,0.001377623,0.9616882,0.001793678,0.0001366527,0.00008480087,0.0003804952,0.0002159881,0.00710432],"genre_scores_gemma":[0.8238733,0.003658405,0.1465244,0.0007514837,0.0003413397,0.001105829,0.0007647846,0.0002016814,0.02277886],"genre_candidate":"methods","genre_consensus":"methods","teacher_disagreement_score":0.008561006,"threshold_uncertainty_score":0.01702237,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.03745182810977304,"score_gpt":0.2729878616903039,"score_spread":0.2355360335805309,"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."}}