Acceleration of molecular dynamics simulation of multiphase systems on GPU
2012 ◽
Vol 9
(2)
◽
pp. 76-79
Keyword(s):
The paper presents results on acceleration of molecular dynamics simulations with the usage of GPUs. A system of water molecules is considered as an example of polar liquid. The intermolecular interaction is modeled with the usage of Coulomb and truncated Lennard-Jones potentials. Results of computational experiments on acceleration and performance of the developed code are presented.
2015 ◽
Vol 17
(45)
◽
pp. 30307-30317
◽
2020 ◽
Vol 22
(3)
◽
pp. 1154-1167
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2014 ◽
Vol 16
(39)
◽
pp. 21706-21716
◽