{"id":"W2945120059","doi":"10.1016/j.jmgm.2019.05.013","title":"New modeling method to simulate asphaltenes at oil sands process in water management","year":2019,"lang":"en","type":"article","venue":"Journal of Molecular Graphics and Modelling","topic":"Petroleum Processing and Analysis","field":"Chemistry","cited_by":20,"is_retracted":false,"has_abstract":false,"ca_institutions":"University of Alberta; Natural Resources Canada","funders":"University of Illinois at Urbana-Champaign; Yangtze University","keywords":"Asphaltene; Oil sands; Molecular dynamics; Asphalt; Radius of gyration; Materials science; Diffusion; Chemistry; Hildebrand solubility parameter; Chemical engineering; Solubility; Thermodynamics; Organic chemistry; Computational chemistry; Composite material; Polymer","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":[0.0002655605,0.0006503692,0.0007213064,0.0006185633,0.0007586245,0.000789904,0.001495937,0.001353334,0.004231736],"category_scores_gemma":[0.0006439949,0.0004368267,0.0009279378,0.0006267554,0.0002808754,0.0008864027,0.0005586609,0.0008356324,0.0005123973],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0006022066,"about_ca_system_score_gemma":0.001375181,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.01555385,"about_ca_topic_score_gemma":0.009403626,"domain_scores_codex":[0.9998542,0.0000278768,0.000009648602,0.000026313,0.00006160368,0.00002033618],"domain_scores_gemma":[0.9997744,0.00007134346,0.00002023709,0.00002087638,0.000088319,0.00002477018],"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":[0.0000584658,0.0001063963,0.001579326,0.00009357995,0.00004819817,0.0001725482,0.0000726837,0.9670625,0.006905565,0.006612026,0.001321443,0.01596723],"study_design_scores_gemma":[0.000008407221,0.000007351589,0.00007102789,0.000002561183,0.000005586217,0.00001465303,0.0000058977,0.9976804,0.0007623102,0.0003962368,0.001041092,0.000004383952],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"methods","genre_gemma":"methods","genre_scores_codex":[0.09206324,0.0005728935,0.8879757,0.0004319613,0.0003657431,0.0001926776,0.0007256833,0.001783612,0.01588849],"genre_scores_gemma":[0.7108506,0.0009759799,0.2644579,0.0001873304,0.0001088058,0.0005906918,0.000980933,0.0006633442,0.02118444],"genre_candidate":"methods","genre_consensus":"methods","teacher_disagreement_score":0.01555385,"threshold_uncertainty_score":0.03092659,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0134381615607668,"score_gpt":0.268212229159014,"score_spread":0.2547740675982472,"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."}}