{"id":"W2034475831","doi":"10.1038/nature11691","title":"Automated design of ligands to polypharmacological profiles","year":2012,"lang":"en","type":"article","venue":"Nature","topic":"Computational Drug Discovery Methods","field":"Computer Science","cited_by":845,"is_retracted":false,"has_abstract":false,"ca_institutions":"Université de Montréal; Montreal Clinical Research Institute","funders":"National Institute of Mental Health; Biotechnology and Biological Sciences Research Council; National Institute on Drug Abuse; Wellcome Trust","keywords":"Drug; Drug discovery; Computer science; Computational biology; Drug target; Bioinformatics; Pharmacology; Medicine; Biology","routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.03147031858431396,"score_gpt":0.3637176719870286,"score_spread":0.3322473534027147,"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."}}