Unify FEP period setting
authorPascal Merz <pascal.merz@me.com>
Tue, 8 Jun 2021 15:31:59 +0000 (15:31 +0000)
committerPascal Merz <pascal.merz@me.com>
Tue, 8 Jun 2021 15:31:59 +0000 (15:31 +0000)
commite2c8bcc0691c2e081002eea7e7c0f9044782ccbb
tree70f935a6bc834b204082b6e099be9996b3f73bbc
parentc539e2bf2fa267cf06f5f1b36939f0b7c4e37273
Unify FEP period setting
src/gromacs/mdrun/md.cpp
src/gromacs/mdrunutility/CMakeLists.txt
src/gromacs/mdrunutility/freeenergy.cpp [new file with mode: 0644]
src/gromacs/mdrunutility/freeenergy.h [new file with mode: 0644]
src/gromacs/modularsimulator/simulatoralgorithm.cpp