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(parent: d56c6f6) | patch
Move QMMM source to C++
authorErik Lindahl <erik@kth.se>
Tue, 7 Jul 2015 20:50:41 +0000 (22:50 +0200)
committerErik Lindahl <erik@kth.se>
Tue, 7 Jul 2015 22:45:55 +0000 (00:45 +0200)
commitf7e76b5e296e23aa8de0103140811473b5515013
tree33cc3c3ebad7e87d14ed30ce8e53d52c2a7c0091tree | snapshot
parentd56c6f64ef2ba1ec31ec495c5204adbad24ab9eecommit | diff
Move QMMM source to C++

Tested by enabling the four different QM/MM interfaces,
but not linking to the actual programs since those calls
are still unaltered.

Change-Id: I86163a0db56003687e6226a78169141af98940b7
src/gromacs/mdlib/qm_gamess.cpp [moved from src/gromacs/mdlib/qm_gamess.c with 95% similarity] diff | blob | history
src/gromacs/mdlib/qm_gaussian.cpp [moved from src/gromacs/mdlib/qm_gaussian.c with 97% similarity] diff | blob | history
src/gromacs/mdlib/qm_mopac.cpp [moved from src/gromacs/mdlib/qm_mopac.c with 91% similarity] diff | blob | history
src/gromacs/mdlib/qm_orca.cpp [moved from src/gromacs/mdlib/qm_orca.c with 98% similarity] diff | blob | history
src/gromacs/mdlib/qmmm.cpp [moved from src/gromacs/mdlib/qmmm.c with 95% similarity] diff | blob | history
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