| commit | a975d0c0f033272814632255c9151a6224a524bc | |
| author | Berk Hess <hess@kth.se> | |
| Thu, 14 Apr 2016 10:53:23 +0000 (14 12:53 +0200) | ||
| committer | Szilárd Páll <pall.szilard@gmail.com> | |
| Fri, 6 May 2016 11:51:39 +0000 (6 13:51 +0200) | ||
| tree | 71f3d62db8b66926eb01063c25638e5b7d32b9a1 | treesnapshot (tar.gz zip) |
| parent | 4f964e354b1df3bdfc5485317d0462b736f4cdf4 | commitdiff |
OpenMP parallelization for pull
The pull code could take up to a third of the compute time for OpenMP
parallelel simulation with large pull groups.
Now all loops over atoms have an OpenMP parallel version.
Change-Id: I59e65a3e33782828cca58cb843c33afd1502e4b5
The pull code could take up to a third of the compute time for OpenMP
parallelel simulation with large pull groups.
Now all loops over atoms have an OpenMP parallel version.
Change-Id: I59e65a3e33782828cca58cb843c33afd1502e4b5
| src/gromacs/pulling/pull.cpp | diffblobblamehistory | |
| src/gromacs/pulling/pull_internal.h | diffblobblamehistory | |
| src/gromacs/pulling/pullutil.cpp | diffblobblamehistory |