[gmx-users] gmxbench-3.0 instructions?

David van der Spoel spoel at xray.bmc.uu.se
Sun Aug 8 16:36:35 CEST 2004

On Sat, 7 Aug 2004, Jack Howarth wrote:

>    Are there any instructions for running the gmxbench-3.0 benchmarks?
>I ask because I want to benchmark a gromacs-3.2.1 package built under
>fink against an altivec enabled fftw fink package on a dual 2GHz G5
>to compare it to what is in the current table. Thanks in advance.
>                     Jack
in principle just:
grompp -np 2
mpirun -np 2 mdrun

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David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://xray.bmc.uu.se/~spoel

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