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Could RASPA 2.0 utilizes GPU? #39

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ppropess opened this issue Oct 16, 2018 · 0 comments

ppropess commented Oct 16, 2018

Hi,

I'm about to purchase new sever for running RASPA 2,
but could RASPA 2 utilizes GPU in the computer?

Nvidia provides the performance enhancement data for various molercular simulation tools but
there is no test for RASPA.
https://www.nvidia.com/object/computational_chemistry.html

Seo-Yul Kim
Chemical engineering, Yonsei university

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