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For our work, we extensively use HALMD: a highly accelerated largescale molecular dynamics simulation package, specifically designed for GPU based simulations.
Some unassorted Links:
Figshare: https://figshare.com/authors/Sutapa_Roy/6291314
Figshare: https://figshare.com/authors/Sutapa_Roy/12561865
Talk: https://www.linkedin.com/feed/update/urn:li:activity:6900505781339578368
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