{"id":"W4205976291","doi":"10.3390/molecules25132968","title":"Breakthroughs in Medicinal Chemistry: New Targets and Mechanisms, New Drugs, New Hopes–7","year":2020,"lang":"en","type":"editorial","venue":"Molecules","topic":"Computational Drug Discovery Methods","field":"Computer Science","cited_by":6,"is_retracted":false,"has_abstract":true,"ca_institutions":"Structural Genomics Consortium; Canada Research Chairs; University of Toronto","funders":"National Institute of Neurological Disorders and Stroke; National Cancer Institute","keywords":"Chemistry; Nanotechnology; Engineering ethics; Engineering; Materials science","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":[0.007588567,0.002421072,0.002190969,0.002773424,0.00246236,0.009286578,0.002464971,0.006482905,0.0368977],"category_scores_gemma":[0.02112751,0.0007836497,0.001509411,0.001330518,0.002727332,0.005405354,0.001569604,0.01208748,0.02712419],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.002266947,"about_ca_system_score_gemma":0.005326498,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0008495629,"about_ca_topic_score_gemma":0.00310092,"domain_scores_codex":[0.9936985,0.001103862,0.0004714385,0.000451921,0.003912377,0.0003618074],"domain_scores_gemma":[0.9661741,0.01287601,0.001464671,0.0007708092,0.01306646,0.005647813],"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":[0.0000299247,0.000006794033,0.00001153076,0.0001336291,0.000007186079,0.00002748825,0.000005146243,0.00002359744,0.00004492469,0.001029938,0.9917174,0.006962354],"study_design_scores_gemma":[0.00004298813,0.0000305874,0.00009531387,0.0002744439,0.00001463488,0.0001019054,0.00002439198,0.0001758779,0.00008320642,0.003522805,0.9956208,0.00001299279],"study_design_candidate":"not_applicable","study_design_consensus":"not_applicable","genre_codex":"editorial","genre_gemma":"editorial","genre_scores_codex":[0.00003380084,0.006163852,0.0002011667,0.01963279,0.9701644,0.00001302886,0.00006500951,0.00008435921,0.003641471],"genre_scores_gemma":[0.0007047337,0.009409417,0.0003178126,0.01873221,0.9483967,0.0000193075,0.0000952093,0.0001107715,0.02221382],"genre_candidate":"editorial","genre_consensus":"editorial","teacher_disagreement_score":0.0368977,"threshold_uncertainty_score":0.1234351,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.008701919654174708,"score_gpt":0.2672204616979973,"score_spread":0.2585185420438226,"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."}}