Enforced rotation: PBC/restart fix
authorCarsten Kutzner <ckutzne@gwdg.de>
Fri, 15 Jun 2012 12:43:35 +0000 (14:43 +0200)
committerGerrit Code Review <gerrit@gerrit.gromacs.org>
Fri, 6 Jul 2012 18:49:06 +0000 (20:49 +0200)
commiteb149eb539d92b97cbf095f9bf68c15d015c0594
tree8c40f866fcc7045dcae8fbe01e2c0deea9e72566
parent6057a9707e4d1481e07be6ee68067655e38b0c45
Enforced rotation: PBC/restart fix

... for rot groups consisting of >1 molecule. This commit fixes a problem with checkpoint-restarts
when using a rotation group consisting of more than a single molecule.

Change-Id: I7378047b5cd0909b864a62200ded747682f627a1
src/kernel/runner.c
src/mdlib/pull_rotation.c