CHARMM-GUI Input Generator for NAMD, GROMACS, AMBER, OpenMM, and CHARMM/OpenMM Simulations Using the CHARMM36 Additive Force Field

Bibliographic Details
Main Authors: Lee, Jumin, Cheng, Xi, Swails, Jason M., Yeom, Min Sun, Eastman, Peter K., Lemkul, Justin A., Wei, Shuai, Buckner, Joshua, Jeong, Jong Cheol, Qi, Yifei, Jo, Sunhwan, Pande, Vijay S., Case, David A., Brooks, Charles L., MacKerell, Alexander D., Klauda, Jeffery B., Im, Wonpil
Format: Online
Language:English
Published: American Chemical Society 2015
Online Access:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4712441/
id pubmed-4712441
recordtype oai_dc
spelling pubmed-47124412016-01-21 CHARMM-GUI Input Generator for NAMD, GROMACS, AMBER, OpenMM, and CHARMM/OpenMM Simulations Using the CHARMM36 Additive Force Field Lee, Jumin Cheng, Xi Swails, Jason M. Yeom, Min Sun Eastman, Peter K. Lemkul, Justin A. Wei, Shuai Buckner, Joshua Jeong, Jong Cheol Qi, Yifei Jo, Sunhwan Pande, Vijay S. Case, David A. Brooks, Charles L. MacKerell, Alexander D. Klauda, Jeffery B. Im, Wonpil American Chemical Society 2015-11-12 2016-01-12 /pmc/articles/PMC4712441/ /pubmed/26631602 http://dx.doi.org/10.1021/acs.jctc.5b00935 Text en Copyright © 2015 American Chemical Society This is an open access article published under an ACS AuthorChoice License (http://pubs.acs.org/page/policy/authorchoice_termsofuse.html) , which permits copying and redistribution of the article or any adaptations for non-commercial purposes.
repository_type Open Access Journal
institution_category Foreign Institution
institution US National Center for Biotechnology Information
building NCBI PubMed
collection Online Access
language English
format Online
author Lee, Jumin
Cheng, Xi
Swails, Jason M.
Yeom, Min Sun
Eastman, Peter K.
Lemkul, Justin A.
Wei, Shuai
Buckner, Joshua
Jeong, Jong Cheol
Qi, Yifei
Jo, Sunhwan
Pande, Vijay S.
Case, David A.
Brooks, Charles L.
MacKerell, Alexander D.
Klauda, Jeffery B.
Im, Wonpil
spellingShingle Lee, Jumin
Cheng, Xi
Swails, Jason M.
Yeom, Min Sun
Eastman, Peter K.
Lemkul, Justin A.
Wei, Shuai
Buckner, Joshua
Jeong, Jong Cheol
Qi, Yifei
Jo, Sunhwan
Pande, Vijay S.
Case, David A.
Brooks, Charles L.
MacKerell, Alexander D.
Klauda, Jeffery B.
Im, Wonpil
CHARMM-GUI Input Generator for NAMD, GROMACS, AMBER, OpenMM, and CHARMM/OpenMM Simulations Using the CHARMM36 Additive Force Field
author_facet Lee, Jumin
Cheng, Xi
Swails, Jason M.
Yeom, Min Sun
Eastman, Peter K.
Lemkul, Justin A.
Wei, Shuai
Buckner, Joshua
Jeong, Jong Cheol
Qi, Yifei
Jo, Sunhwan
Pande, Vijay S.
Case, David A.
Brooks, Charles L.
MacKerell, Alexander D.
Klauda, Jeffery B.
Im, Wonpil
author_sort Lee, Jumin
title CHARMM-GUI Input Generator for NAMD, GROMACS, AMBER, OpenMM, and CHARMM/OpenMM Simulations Using the CHARMM36 Additive Force Field
title_short CHARMM-GUI Input Generator for NAMD, GROMACS, AMBER, OpenMM, and CHARMM/OpenMM Simulations Using the CHARMM36 Additive Force Field
title_full CHARMM-GUI Input Generator for NAMD, GROMACS, AMBER, OpenMM, and CHARMM/OpenMM Simulations Using the CHARMM36 Additive Force Field
title_fullStr CHARMM-GUI Input Generator for NAMD, GROMACS, AMBER, OpenMM, and CHARMM/OpenMM Simulations Using the CHARMM36 Additive Force Field
title_full_unstemmed CHARMM-GUI Input Generator for NAMD, GROMACS, AMBER, OpenMM, and CHARMM/OpenMM Simulations Using the CHARMM36 Additive Force Field
title_sort charmm-gui input generator for namd, gromacs, amber, openmm, and charmm/openmm simulations using the charmm36 additive force field
description
publisher American Chemical Society
publishDate 2015
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4712441/
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