Remove dysfunctional QMMM interface pt2
authorChristian Blau <cblau@gwdg.de>
Fri, 13 Mar 2020 17:45:52 +0000 (18:45 +0100)
committerChristian Blau <cblau@gerrit.gromacs.org>
Mon, 16 Mar 2020 09:51:27 +0000 (10:51 +0100)
commit75b99213cea2afb1523401bde72a3446fbdf17ea
tree6075fb360f96ba9009c46a22966f3e1ce68f2f32
parente67f9e8c189137e044db1ccedc61801d71c11721
Remove dysfunctional QMMM interface pt2

Uncoupling from forcerec, deleting unused files.

Change-Id: Id72281a26b8b39b6d2a37f5f8a43330f399ce5aa
18 files changed:
docs/user-guide/environment-variables.rst
src/gromacs/gmxpreprocess/grompp.cpp
src/gromacs/mdlib/force.cpp
src/gromacs/mdlib/forcerec.cpp
src/gromacs/mdlib/mdatoms.cpp
src/gromacs/mdlib/qm_gamess.cpp [deleted file]
src/gromacs/mdlib/qm_gamess.h [deleted file]
src/gromacs/mdlib/qm_gaussian.cpp [deleted file]
src/gromacs/mdlib/qm_gaussian.h [deleted file]
src/gromacs/mdlib/qm_mopac.cpp [deleted file]
src/gromacs/mdlib/qm_mopac.h [deleted file]
src/gromacs/mdlib/qm_orca.cpp [deleted file]
src/gromacs/mdlib/qm_orca.h [deleted file]
src/gromacs/mdlib/qmmm.cpp [deleted file]
src/gromacs/mdlib/qmmm.h [deleted file]
src/gromacs/mdlib/sim_util.cpp
src/gromacs/mdrun/runner.cpp
src/gromacs/mdtypes/forcerec.h