biod.pnpi.spb.ru / alexxy / gromacs.git / commit
? search:
summary | shortlog | log | commit | commitdiff | tree
(parent: 643e75d) | patch
Correct for skewed box before domain decomposition (modular simulator)
authorPascal Merz <pascal.merz@me.com>
Tue, 22 Oct 2019 22:05:07 +0000 (16:05 -0600)
committerMark Abraham <mark.j.abraham@gmail.com>
Wed, 23 Oct 2019 08:04:29 +0000 (10:04 +0200)
commitfba672df54a005e9e7e041a645953e63dfcc76c8
tree5f8e0b8dd9f96affa7cf69e7bad96b2de4f35926tree | snapshot
parent643e75dac184951c31035261a488f0eef14a9b36commit | diff
Correct for skewed box before domain decomposition (modular simulator)

The correction for skewed boxes before domain decomposition is done
in the legacy code, but was missing in the modular simulator.

Change-Id: I202629c1b546247c64b09e491cfb09db402ca1b1
src/gromacs/modularsimulator/domdechelper.cpp diff | blob | history
Local GROMACS mirror with custom stuff