Add missing mass term to deltaH
authorBerk Hess <hess@kth.se>
Wed, 24 Oct 2018 06:37:35 +0000 (08:37 +0200)
committerMark Abraham <mark.j.abraham@gmail.com>
Fri, 26 Oct 2018 11:25:14 +0000 (13:25 +0200)
commitb51dbae2a81a1f719c96442f7120ff0807fa1e49
treee4d2db1568480eff5205b5d77fdf42fc76436765
parent1d8678d9d91785dd38bc2e359f13ec1feeff0f4e
Add missing mass term to deltaH

The mass contribution was missing from foreign Hamiltonian difference
output from mdrun used for BAR.

Refs #2703

Change-Id: I415c835e9e1a8473243041be004013af7141a1cc
docs/release-notes/2018/2018.4.rst
src/gromacs/mdlib/force.cpp