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(parent: a6776ef) | patch
Fix LINCS triangle constraining with OpenMP
authorBerk Hess <hess@kth.se>
Thu, 13 Dec 2018 11:06:54 +0000 (12:06 +0100)
committerPaul Bauer <paul.bauer.q@gmail.com>
Fri, 14 Dec 2018 15:21:46 +0000 (16:21 +0100)
commit230258223124fdb3d903016be5c3b1400b5574dc
treee7fd38c9f1394ea94c769b6ecd2247703d0112fatree | snapshot
parenta6776ef48901809d05713620b01a498d7a569372commit | diff
Fix LINCS triangle constraining with OpenMP

LINCS would only apply double the iterations to constraints
in triangles when the last OpenMP task contained at least one such
triangle.

Fixes #2808

Change-Id: Ia9a402f3ada87dbf73f74eda943b3fa4bfb3559b
docs/release-notes/2018/2018.5.rst diff | blob | history
src/gromacs/mdlib/clincs.cpp diff | blob | history
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