Consistently change densityfitting spreading weight to charge
commitec5a5533194426c4393464ef6d2e1ef55868be77
authorChristian Blau <cblau@gwdg.de>
Wed, 18 Sep 2019 10:11:43 +0000 (18 12:11 +0200)
committerMark Abraham <mark.j.abraham@gmail.com>
Thu, 19 Sep 2019 05:53:05 +0000 (19 07:53 +0200)
tree85ab0c646d4e746b2237ebf4f71868adfc3a8549
parent5397e5ae8f59443f3db3b3dee156ee5735ad4757
Consistently change densityfitting spreading weight to charge

In the mdp options, the density-guided-simulation-atom-spreading weight
has been changed from charges to "charge" but within the code and in an
.mdp file comment the plural charges was still used. Changed now all
over to make this consistent.

refs #2282

Change-Id: I055743c8301e4ad18ceed5670c62be0a93c2d5f1
src/gromacs/applied_forces/densityfittingamplitudelookup.cpp
src/gromacs/applied_forces/densityfittingamplitudelookup.h
src/gromacs/applied_forces/densityfittingoptions.cpp
src/gromacs/applied_forces/tests/densityfittingamplitudelookup.cpp
src/gromacs/applied_forces/tests/densityfittingoptions.cpp