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[task #15639] Building GROMACS in Maneage

From: Surena Fatemi
Subject: [task #15639] Building GROMACS in Maneage
Date: Wed, 13 May 2020 12:48:39 -0400 (EDT)
User-agent: Mozilla/5.0 (X11; Linux x86_64) AppleWebKit/537.36 (KHTML, like Gecko) Chrome/74.0.3729.169 Safari/537.36

Follow-up Comment #1, task #15639 (project reproduce):

[comment #0 original submission:]
> "GROMACS <> is a versatile package to
perform molecular dynamics, i.e. simulate the Newtonian equations of motion
for systems with hundreds to millions of particles." It is a commonly used
package in molecular dynamics simulations and has been proposed to be included
in Maneage by Yahya Sefidbakht.
> Its installation instructions
are also available and fortunately it seems to only depend on FFTW, other than
that apparently it just needs a C compiler!
> So it should be fairly easy to include it in the `' step.
Surena, do have time to try adding it to Maneage? 


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