Fix conditional in assertion
authorArtem Zhmurov <zhmurov@gmail.com>
Tue, 11 May 2021 05:57:07 +0000 (08:57 +0300)
committerArtem Zhmurov <zhmurov@gmail.com>
Tue, 11 May 2021 08:33:39 +0000 (08:33 +0000)
commit7a99c84eba57908d4f5e4ac749007d1485312d12
treebc2962500e635ca6b8efb3213085f3402eab2d37
parentf80cfc36ac35e7b0cbfb747d61d7d4a1e21e705a
Fix conditional in assertion

The B-charges should be defined to use FEP in PME. The condition
was changed to the opposite in fdac5efa5ed51dd9b8486ca35227708b62fb08ef
src/gromacs/ewald/pme.cpp