[gmx-users] Regression test for mdrun only installation
Mark Abraham
mark.j.abraham at gmail.com
Mon Jul 13 13:31:59 CEST 2015
Hi,
No. The full gmx binary is needed for that test suite, for running
preparatory and analysis tools in the suite. Probably the mdrun and the gmx
must share a common suffix w.r.t. _mpi or _d (or no suffix at all), but
otherwise if an mdrun-only build is installed on top of a full build, then
things will work fine.
Mark
On Mon, Jul 13, 2015 at 1:15 PM Kortzak, Daniel <d.kortzak at fz-juelich.de>
wrote:
> Dear GMX-Users,
>
> just one quick question: is there a simple way to do the regression test
> with a mdrun-only build of gromacs 5.05?
>
> cheers,
> Daniel
>
>
>
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