[gmx-users] gromacs and openmp

David spoel at xray.bmc.uu.se
Wed Apr 27 22:21:13 CEST 2005


On Wed, 2005-04-27 at 20:08 +0200, Jesus Salgado wrote:
> Short question: Can gromacs be compiled for "openmp"?

There are no openmp directives so it won't help. MPI works fine.

> 
> Thanks,
> Jesus
-- 
David.
________________________________________________________________________
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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