UCL-ARC / UCL-ARC/rcps-buildscripts

Install Request: GPU build of GROMACS 2021.5

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#467 16 comments 0 reactions 1 assignee View on GitHub

@heatherkellyucl is already working on this.

Since Jan 17, 2022.

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Description

EPSRC work, plus IN:05095607

Do a GPU build of the current version (GROMACS 2021.5)

https://manual.gromacs.org/current/install-guide/index.html

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