[gmx-users] GROMACS 2018.3 ansible playbook for wget, extract, build, install

Benson Muite benson.muite at ut.ee
Fri Nov 9 18:00:10 CET 2018

There is also an rpm:


for other versions see:


On 11/9/18 6:54 PM, Benson Muite wrote:
> The installation instructions (http://manual.gromacs.org/documentation/2018/install-guide/index.html) make it possible to write a simple shell script - though optmizing may require a few more tests. For example to install a basic configuration in $HOME/gromacs use
> wget ftp.gromacs.org/pub/gromacs/gromacs-2018.3.tar.gz<ftp://ftp.gromacs.org/pub/gromacs/gromacs-2018.3.tar.gz>
> tar xfz gromacs-2018.3.tar.gz
> cd gromacs-2018.3
> mkdir build
> cd build
> make
> make check
> sudo make install
> source $HOME/gromacs/bin/GMXRC
> On 11/9/18 5:59 PM, Darin Lory-External wrote:
> To distribution,
> Does anybody have a GROMACS 2018.3 (or any version) ansible playbook for wget, extract, build, install or even a nice shell script for Linux (RHEL, but I can convert other linuxes)
> Darin S Lory
> Email: darin.lory at regeneron.com<mailto:darin.lory at regeneron.com>

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