SIMD acceleration for RB dihedrals
commitae4be0412cd8d7c1514e4bc0e29a33f5fa845309
authorBerk Hess <hess@kth.se>
Thu, 25 Sep 2014 18:35:55 +0000 (25 20:35 +0200)
committerGerrit Code Review <gerrit@gerrit.gromacs.org>
Mon, 29 Sep 2014 15:35:32 +0000 (29 17:35 +0200)
tree2c3d0761dbf01ec4e580bc64fff7c9d952b3cda9
parent4e26aee50b6476a4c01c0eaf3650b1766e9b1659
SIMD acceleration for RB dihedrals

RB dihedrals now use SIMD acceleration analogous to proper dihedrals
when no energy and virial is required. This also significantly
improves load balancing (issues) for systems with proper+RB dihedrals.
Refs #1598.

Change-Id: I07000125d19db45fc35e1a0c28149c8a19443680
src/gromacs/gmxlib/bondfree.c