Fix exception in SIMD LJ PME solve
commit16f9979fb325ca898e2d26b2ae0244908e761fb5
authorBerk Hess <hess@kth.se>
Fri, 8 Sep 2017 13:35:23 +0000 (8 15:35 +0200)
committerAleksei Iupinov <a.yupinov@gmail.com>
Tue, 12 Sep 2017 09:59:35 +0000 (12 11:59 +0200)
tree5d6436524d5f038ef1beff2804ffd90813198b01
parentbb4128daf630719a670dc795b2cf2cc937c2c8f1
Fix exception in SIMD LJ PME solve

Clear SIMD padding elements in solve helper arrays to avoid,
otherwise harmles, fp overflow exceptions.

Fixes #2242

Change-Id: I97e67c4fcc2ef361f54d1627fd0dab4621f4bd33
src/gromacs/ewald/pme-solve.cpp