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Generative Models for Molecular Design

Kenneth M. Merz, Gianni De Fabritiis, Guo‐Wei Wei

2020Journal of Chemical Information and Modeling25 citationsDOI

Abstract

ADVERTISEMENT RETURN TO ISSUEEditorialNEXTGenerative Models for Molecular DesignKenneth M. Merz Jr.*Kenneth M. Merz, Jr.Department of Chemistry, Michigan State University, Michigan, East Lansing 48824, United States*Email: [email protected] (K.M.M.).More by Kenneth M. Merz, Jr.http://orcid.org/0000-0001-9139-5893, Gianni De FabritiisGianni De FabritiisComputational Science Laboratory, Barcelona Biomedical Research Park (PRBB), Universitat Pompeu Fabra, C Dr Aiguader 88, 08003 Barcelona, SpainMore by Gianni De Fabritiishttp://orcid.org/0000-0003-3913-4877, and Guo-Wei WeiGuo-Wei WeiDepartment of Mathematics, Michigan State University, Michigan, East Lansing 48824, United StatesMore by Guo-Wei Weihttp://orcid.org/0000-0002-5781-2937Cite this: J. Chem. Inf. Model. 2020, 60, 12, 5635–5636Publication Date (Web):December 28, 2020Publication History Published online28 December 2020Published inissue 28 December 2020https://pubs.acs.org/doi/10.1021/acs.jcim.0c01388https://doi.org/10.1021/acs.jcim.0c01388editorialACS PublicationsCopyright © 2020 American Chemical Society. This publication is available under these Terms of Use. Request reuse permissions This publication is free to access through this site. Learn MoreArticle Views4518Altmetric-Citations8LEARN ABOUT THESE METRICSArticle Views are the COUNTER-compliant sum of full text article downloads since November 2008 (both PDF and HTML) across all institutions and individuals. These metrics are regularly updated to reflect usage leading up to the last few days.Citations are the number of other articles citing this article, calculated by Crossref and updated daily. Find more information about Crossref citation counts.The Altmetric Attention Score is a quantitative measure of the attention that a research article has received online. Clicking on the donut icon will load a page at altmetric.com with additional details about the score and the social media presence for the given article. Find more information on the Altmetric Attention Score and how the score is calculated. Share Add toView InAdd Full Text with ReferenceAdd Description ExportRISCitationCitation and abstractCitation and referencesMore Options Share onFacebookTwitterWechatLinked InRedditEmail PDF (523 KB) Get e-AlertscloseSUBJECTS:Drug discovery,Molecular design,Molecular modeling,Molecules,Pharmaceuticals Get e-Alerts

Topics & Concepts

Generative grammarComputer scienceGenerative modelComputational biologyArtificial intelligenceBiologyComputational Drug Discovery MethodsChemistry and Chemical EngineeringMachine Learning in Materials Science
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