Accelerating Molecular Dynamics Simulation Using Graphics Processing Unit
نویسندگان
چکیده
منابع مشابه
Accelerating Molecular Dynamics Simulation Using Graphics Processing Unit
We have developed CUDA-enabled version of a general purpose molecular dynamics simulation code for GPU. Implementation details including parallelization scheme and performance optimization are described. Here we have focused on the non-bonded force calculation because it is most time consuming part in molecular dynamics simulation. Timing results using CUDA-enabled and CPU versions were obtaine...
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ژورنال
عنوان ژورنال: Bulletin of the Korean Chemical Society
سال: 2010
ISSN: 0253-2964
DOI: 10.5012/bkcs.2010.31.12.3639