Employing multi-GPU power for molecular dynamics simulation: an extension of GALAMOST-Reference-Cited by-同舟云学术

Employing multi-GPU power for molecular dynamics simulation: an extension of GALAMOST

Published:2018-02-12 Issue:7-8 Volume:116 Page:1065-1077
ISSN:0026-8976
Container-title:Molecular Physics
language:en
Short-container-title:Molecular Physics

Author:

Zhu You-Liang¹,Pan Deng¹,Li Zhan-Wei¹,Liu Hong²,Qian Hu-Jun²,Zhao Yang³,Lu Zhong-Yuan²,Sun Zhao-Yan¹

Affiliation:

1. State Key Laboratory of Polymer Physics and Chemistry, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun, Jilin Province, China

2. State Key Laboratory of Supramolecular Structure and Materials, Institute of Theoretical Chemistry, Jilin University, Changchun, Jilin Province, China

3. National Supercomputer Center in Tianjin, Tianjin, China

Funder

National Natural Science Foundation of China

Publisher

Informa UK Limited

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics

Link

https://www.tandfonline.com/doi/pdf/10.1080/00268976.2018.1434904

Reference76 articles.

1. M.P. Allen, Introduction to Molecular Dynamics Simulation, in Computational Soft Matter: From Synthetic Polymers to Proteins, edited by N. Attig et al. (Johnvon Neumann Institute for Computing, 23, 1–28, 2004).

2. The Gibbs Ensemble

3. Dynamical Heterogeneities in a Supercooled Lennard-Jones Liquid

4. Molecular Dynamics Simulations of the Complete Satellite Tobacco Mosaic Virus

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