[gmx-users] Fedora port of Gromacs available

[Jussi Lehtola]

On Tue, 2008-10-21 at 10:11 +0300, Jussi Lehtola wrote:
> installing GROMACS has just become that much easier. I have made RPMs
> that have now been included in Fedora 8 and Fedora 9. The packages are
> also available in the Fedora EPEL testing branches
> ( http://fedoraproject.org/wiki/EPEL ).
> 
> In Fedora 8-> install with the following command:
> 	$ yum -y install gromacs
> If you also want to be able to run with MPI parallelization:
> 	$ yum -y install gromacs{‚-mpi}

NB. Some binaries have been renamed. All of the binaries start with g_ ,
for example:

	g_grompp
	g_mdrun
	g_x2top
	g_pdb2gmx

The above mentioned are single precision versions. To use the double
precision version, use e.g.

	g_grompp_d
	g_mdrun_d
	g_x2top_d
	g_pdb2gmx_d

And, for MPI enabled binaries (at the moment only mdrun is packaged):

	g_mdrun_mpi
	g_mdrun_mpi_d

The first is the MPI single precision version and the second is the MPI
double precision version.
-- 
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Jussi Lehtola, FM, Tohtorikoulutettava
Fysiikan laitos, Helsingin Yliopisto
jussi.lehtola at helsinki.fi, p. 191 50623
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Mr. Jussi Lehtola, M. Sc., Doctoral Student
Department of Physics, University of Helsinki, Finland
jussi.lehtola at helsinki.fi
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