Francisco Tufró wrote:
Hello list,
My name is Francisco and I'm configuring a cluster to run gromacs using mpi.
As far as i concern i have to install both gromacs and gromacs-mpi. The
question is: do i have to install it on every cluster machinne?
i have made some tests and it seems that the answer is yes, but i would
like to ask to you before continuing.
If anyone has successfuly configured gromacs-mpi (i'm using the rocks
cluster 4.0) please contactme to share the experience.
Thanks!
That's probably the most common combination.
You just need one version of gromacs
./configure --enable-mpi
Francisco Tufró.
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David.
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David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
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