Accelerated Molecular Dynamics Simulations with the AMOEBA Polarizable Force Field on Graphics Processing Units-Reference-Cited by-同舟云学术

Accelerated Molecular Dynamics Simulations with the AMOEBA Polarizable Force Field on Graphics Processing Units

Published:2013-10-15 Issue:11 Volume:9 Page:4684-4691
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Lindert Steffen¹²,Bucher Denis³⁴,Eastman Peter⁵,Pande Vijay⁵,McCammon J. Andrew¹²³⁴

Affiliation:

1. Department of Pharmacology, University of California San Diego, La Jolla, California 92093United States

2. Center for Theoretical Biological Physics, La Jolla, California 92093United States

3. Howard Hughes Medical Institute, University of California San Diego, La Jolla, California 92093United States

4. Department of Chemistry & Biochemistry, NSF Center for Theoretical Biological Physics, National Biomedical Computation Resource, University of California San Diego, La Jolla, California 92093, United States

5. Department of Bioengineering, Stanford University, Stanford, California 94305, United States

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct400514p

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5. OpenMM: A Hardware-Independent Framework for Molecular Simulations

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