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GPU-ACCELERATED GROMACS
The fastest, easiest way to improve simulation performance by up to 3X.
GPU- ACCELERATED GROMACS

GROMACS Benchmark Datasets

This sections presents multi-GPU performance on a single node. In addition, the benchmark shows one, two, and four nodes performance using two Tesla P100 GPU cards per node. Each P100 card has a single Pascal GPU. The runs were accomplished using variations of the command lines described for water data sizes 0768, 1536 and 3072.

 

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