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(parent: c62c499) | patch
Fix grompp note on comm removal with posres
authorBerk Hess <hess@kth.se>
Mon, 30 Aug 2021 08:19:53 +0000 (10:19 +0200)
committerBerk Hess <hess@kth.se>
Mon, 30 Aug 2021 08:19:53 +0000 (10:19 +0200)
commit10719f5860683ebaf10667f8008a4f896250c8e0
tree1b8bb759c8ecd8407f2830ac2aca5245cb8df499tree | snapshot
parentc62c49949017dcc63eefde681194d0ef5405a631commit | diff
Fix grompp note on comm removal with posres

The grompp note with position restraints and center of mass motion
removal checked for absolute reference instead of COMM removal.
This bug was introduced in commit 0c7124d7 when fixing #3996.

Fixes #4128
docs/release-notes/2021/2021.4.rst diff | blob | history
src/gromacs/gmxpreprocess/readir.cpp diff | blob | history
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