[gmx-users] GROMACS simulation with GPU at different nodes

[Mark Abraham]

Hi,

Behaviour related to that does improve in more recent versions, but that
shouldn't drive wanting the newer version. You should be choosing versions
based on what your scientific needs are, and often that means using a
version that's consistent with other work, or that has been shown to work
well, or that gives you all the latest performance improvements.

Mark

On Wed, Oct 19, 2016 at 10:31 AM TaeHwan OH <hadronian at icloud.com> wrote:

Thank you for your reply, Mark.

So… Do you mean that I should reinstall higher version GROMACS?

-TaeHwan OH
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