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Computational Chemistry Benchmarks - Nvidia

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Nanoseconds / Day<br />

Kepler - Our Fastest Family of GPUs Yet<br />

30.00<br />

25.00<br />

20.00<br />

Factor IX<br />

18.90<br />

22.44<br />

6.6x<br />

25.39<br />

7.4x<br />

Running AMBER 12 GPU Support Revision 12.1<br />

The blue node contains Dual E5-2687W CPUs<br />

(8 Cores per CPU).<br />

The green nodes contain Dual E5-2687W CPUs (8<br />

Cores per CPU) and either 1x NVIDIA M2090, 1x K10<br />

or 1x K20 for the GPU<br />

15.00<br />

11.85<br />

5.6x<br />

10.00<br />

5.00<br />

3.42<br />

3.5x<br />

16<br />

0.00<br />

1 CPU Node 1 CPU Node +<br />

M2090<br />

1 CPU Node + K10 1 CPU Node + K20 1 CPU Node + K20X<br />

GPU speedup/throughput increased from 3.5x (with M2090) to 7.4x (with K20X)<br />

when compared to a CPU only node<br />

Factor IX

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