| commit | 3a9e67dd55949e7daaa666e5bc4de95bcfece2c4 | |
| author | Berk Hess <hess@kth.se> | |
| Mon, 23 May 2016 12:42:49 +0000 (23 14:42 +0200) | ||
| committer | Erik Lindahl <erik@kth.se> | |
| Mon, 23 May 2016 22:36:05 +0000 (24 00:36 +0200) | ||
| tree | 67789c957f330678b04f06d156eb5afc51665c4d | treesnapshot (tar.gz zip) |
| parent | 3901dc908e129db6b51d9a531115e2bf77c0dc8d | commitdiff |
Fix bug in v-rescale thermostat & replica exchange
Commit 2d0247f6 made the random normally distributed number for the
v-rescale thermostat constant for a run only depending on ld-seed,
and moved a reset for replica exchange inside the multi-exchange
branch.
Fixes #1968.
Change-Id: Iadc38ccadb99c6c1232756fd595843a01e5f3ce8
Commit 2d0247f6 made the random normally distributed number for the
v-rescale thermostat constant for a run only depending on ld-seed,
and moved a reset for replica exchange inside the multi-exchange
branch.
Fixes #1968.
Change-Id: Iadc38ccadb99c6c1232756fd595843a01e5f3ce8
| src/gromacs/mdlib/coupling.cpp | diffblobblamehistory | |
| src/programs/mdrun/repl_ex.cpp | diffblobblamehistory |