Best bang for your buck: GPU nodes for GROMACS biomolecular simulations
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چکیده
منابع مشابه
Best bang for your buck: GPU nodes for GROMACS biomolecular simulations
The molecular dynamics simulation package GROMACS runs efficiently on a wide variety of hardware from commodity workstations to high performance computing clusters. Hardware features are well-exploited with a combination of single instruction multiple data, multithreading, and message passing interface (MPI)-based single program multiple data/multiple program multiple data parallelism while gra...
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ژورنال
عنوان ژورنال: Journal of Computational Chemistry
سال: 2015
ISSN: 0192-8651,1096-987X
DOI: 10.1002/jcc.24030