[gmx-users] parallel gromacs
tom-lists at jambon.ll.cx
Tue Apr 25 19:19:38 CEST 2006
It is in fact possible. You can tell LAM (or probably any other self-
respecting MPI package) to make use of 4 CPUs on one node; see the
documentation for lamboot and its hosts file.
On Apr 25, 2006, at 10:55 AM, <bruning at mpghdb.desy.de>
<bruning at mpghdb.desy.de> wrote:
> i would like to run gromacs in parallel on a single pc with 4
> processors. as
> far as i understand it, this is not possible using mpi. is that
> correct? and
> if so, what do i have to use instead?
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