{"id":"W4393835896","doi":"10.5281/zenodo.3706976","title":"ePSproc: Ethylene (C2H4), orb 7 (HOMO-1) ionization (B3g), wavefn run, 1.0:2.5:100.0","year":2020,"lang":"en","type":"dataset","venue":"Zenodo (CERN European Organization for Nuclear Research)","topic":"Chemical Reactions and Isotopes","field":"Pharmacology, Toxicology and Pharmaceutics","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"National Research Council Canada","funders":"","keywords":"Orb (optics); Ethylene; Ionization; Chemistry; Materials science; Computer science; Organic chemistry; Artificial intelligence; Ion; Catalysis","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":[0.000705763,0.002877928,0.001539397,0.001615564,0.0009294195,0.002250782,0.003811612,0.002831887,0.1626821],"category_scores_gemma":[0.002776457,0.0009237969,0.001657715,0.003967669,0.0003650005,0.001721747,0.001199151,0.00231568,0.197892],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001876979,"about_ca_system_score_gemma":0.001863791,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.02019215,"about_ca_topic_score_gemma":0.02812652,"domain_scores_codex":[0.9994702,0.00008405295,0.00004525979,0.0001767119,0.0001358055,0.00008797584],"domain_scores_gemma":[0.9991386,0.0002403449,0.00007866087,0.000243725,0.0002112011,0.00008757263],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"not_applicable","study_design_gemma":"not_applicable","study_design_scores_codex":[0.00006728822,0.00001336968,0.0003076779,0.0006702449,0.00002588804,0.00001493241,0.000005464547,0.0004116989,0.0001159206,0.0004898136,0.9967553,0.001122382],"study_design_scores_gemma":[0.0005870546,0.00002232961,0.00211398,0.0002167694,0.00004103364,0.00003911467,0.00002541762,0.0008593022,0.0009820004,0.002682604,0.9924004,0.00002993888],"study_design_candidate":"not_applicable","study_design_consensus":"not_applicable","genre_codex":"dataset","genre_gemma":"dataset","genre_scores_codex":[0.00008002538,0.00006986824,0.00005428728,0.00005277383,0.00002115595,0.000006193192,0.9978907,0.0007116441,0.001113513],"genre_scores_gemma":[0.0004645032,0.00008703606,0.0002922448,0.00007388541,0.000007371872,0.00004294109,0.997668,0.0003054293,0.001058692],"genre_candidate":"dataset","genre_consensus":"dataset","teacher_disagreement_score":0.1626821,"threshold_uncertainty_score":0.544226,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.1339496531841577,"score_gpt":0.3839408518556143,"score_spread":0.2499911986714566,"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."}}