PlaceWaters: Real-time, explicit interface water sampling during Rosetta ligand docking.

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Bibliographic Details
Title: PlaceWaters: Real-time, explicit interface water sampling during Rosetta ligand docking.
Authors: Smith ST; Chemical and Physical Biology Program, Vanderbilt University, Nashville, Tennessee, United States of America.; Center for Structural Biology, Vanderbilt University, Nashville, Tennessee, United States of America., Shub L; Biomedical Informatics Program, University of California San Francisco, San Francisco, California, United States of America.; Institute for Neurodegenerative Diseases, University of California San Francisco, San Francisco, California, United States of America., Meiler J; Center for Structural Biology, Vanderbilt University, Nashville, Tennessee, United States of America.; Departments of Chemistry, Pharmacology, and Biomedical Informatics, Center for Structural Biology and Institute of Chemical Biology, Nashville, Tennessee, United States of America.; Institute for Drug Discovery, Leipzig University Medical School, SAC, Leipzig, Germany.
Source: PloS one [PLoS One] 2022 May 31; Vol. 17 (5), pp. e0269072. Date of Electronic Publication: 2022 May 31 (Print Publication: 2022).
Publication Type: Journal Article; Research Support, U.S. Gov't, Non-P.H.S.; Research Support, N.I.H., Extramural; Research Support, Non-U.S. Gov't
Journal Info: Publisher: Public Library of Science Country of Publication: United States NLM ID: 101285081 Publication Model: eCollection Cited Medium: Internet ISSN: 1932-6203 (Electronic) Linking ISSN: 19326203 NLM ISO Abbreviation: PLoS One Subsets: MEDLINE
Database: MEDLINE Ultimate
Description
ISSN:1932-6203
DOI:10.1371/journal.pone.0269072