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(parent: d682f2f) | patch
Decoupled repl_ex_nst from nstcalcenergy
authorBerk Hess <hess@kth.se>
Tue, 10 Jun 2014 12:38:04 +0000 (14:38 +0200)
committerGerrit Code Review <gerrit@gerrit.gromacs.org>
Wed, 11 Jun 2014 22:56:06 +0000 (00:56 +0200)
commitec74f5259425aa6df35fbca95c018124d156f14a
tree51e9cedabc7f3b81b95aab32007f23b3af3855fbtree | snapshot
parentd682f2f3e31f5b4074b06b4393b59fd7b4bdb2b0commit | diff
Decoupled repl_ex_nst from nstcalcenergy

The replica exchange frequency is automatically changed by mdrun
to a multiple of nstcalcenergy, which is annoying. It turns out that
it doesn't need to be a multiple, so this changing has been removed.
Fixes #1494

Change-Id: I00833f92fd468924f61879aff8b7c85fe79d3c2e
src/programs/mdrun/md.c diff | blob | history
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