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This article is cited in 1 scientific paper (total in 1 paper)
GPAMM – software package for molecular dynamics on graphical processing units
D. S. Tarasova, E. D. Izotovab, D. A. Alishevab, N. I. Akberovab a Supercomputer center of Kazan Scientific Center, Russian Academy of Sciences
b Kazan State University
Abstract:
This work describes software package and algorithms for molecular dynamics using NVIDIA GPU G8x, and G92. All potentials needed for MM2 and AMBER force fields are implemented and combination of different potentials is allowed. Performance comparison of different MD algorithms on GPU and CPU is presented. All software is available from www.gpamm.mntech.ru
Received: 16.04.2008
Citation:
D. S. Tarasov, E. D. Izotova, D. A. Alisheva, N. I. Akberova, “GPAMM – software package for molecular dynamics on graphical processing units”, Mat. Model., 21:3 (2009), 31–40; Math. Models Comput. Simul., 2:1 (2010), 46–54
Linking options:
https://www.mathnet.ru/eng/mm2745 https://www.mathnet.ru/eng/mm/v21/i3/p31
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Abstract page: | 938 | Full-text PDF : | 213 | References: | 65 | First page: | 53 |
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