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(parent: 77356f3) | patch
Fixed pull coord init with rate!=0, t_start!=0
authorBerk Hess <hess@kth.se>
Tue, 2 Dec 2014 10:14:22 +0000 (11:14 +0100)
committerGerrit Code Review <gerrit@gerrit.gromacs.org>
Mon, 8 Dec 2014 21:12:02 +0000 (22:12 +0100)
commitd6397b67eaf867e774ba0dfda49795ced8872f43
tree7c73540531bb4c48df0f8f33df96e0e2806cdfa5tree | snapshot
parent77356f36a2845338c299ad7ef2e8b116512aee75commit | diff
Fixed pull coord init with rate!=0, t_start!=0

When the start time of a simulation is non-zero a pull setup with
coordinates with rate!=0 and pull-start, grompp would generate
incorrect pull init reference values.
Also fixed the layout of the grompp pull coord information table.

Change-Id: I992a40b098853aba0922ec1d596430eb229d64a8
src/gromacs/gmxpreprocess/readpull.c diff | blob | history
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