Novel Directions in Free Energy Methods and Applications

Abstract

ADVERTISEMENT RETURN TO ISSUEEditorialNEXTNovel Directions in Free Energy Methods and ApplicationsKira A. Armacost*Kira A. ArmacostComputational and Structural Chemistry, MRL, Merck & Co., Inc. West Point, Pennsylvania 19486, United States*E-mail: [email protected] (K.A.).More by Kira A. Armacosthttp://orcid.org/0000-0001-9322-7981, Sereina Riniker*Sereina RinikerLaboratory of Physical Chemistry, ETH Zürich, Vladimir-Prelog-Weg 2, 8093 Zürich, Switzerland*E-mail: [email protected] (S.R.).More by Sereina Rinikerhttp://orcid.org/0000-0003-1893-4031, and Zoe Cournia*Zoe CourniaBiomedical Research Foundation Academy of Athens, Soranou Ephessiou 4, 11527 Athens, Greece*E-mail: [email protected] (Z.C.).More by Zoe Courniahttp://orcid.org/0000-0001-9287-364XCite this: J. Chem. Inf. Model. 2020, 60, 1, 1–5Publication Date (Web):January 27, 2020Publication History Published online27 January 2020Published inissue 27 January 2020https://pubs.acs.org/doi/10.1021/acs.jcim.9b01174https://doi.org/10.1021/acs.jcim.9b01174editorialACS 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 Views4614Altmetric-Citations35LEARN 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 (362 KB) Get e-AlertscloseSUBJECTS:Chemical calculations,Chemical reactions,Computer simulations,Electron correlation,Free energy Get e-Alerts