[BUG] OpenMMPMEFep wrappers aren't excluded when OpenMM is missing
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lohedges commented
We need to add the OpenMMPMEFep
wrappers to wrapper/Move/CMakeOpenMMFile.txt
to make sure that they are excluded when OpenMM isn't available. Currently it only has:
# WARNING - AUTOGENERATED FILE - CONTENTS WILL BE OVERWRITTEN!
set ( PYPP_OPENMM_SOURCES
OpenMMMDIntegrator.pypp.cpp
OpenMMFrEnergyDT.pypp.cpp
OpenMMFrEnergyST.pypp.cpp
)
(I'm not sure if this file was autogenerated since the only mention of the file name is within wrapper/Move/CMakeLists.txt
itself.)
lohedges commented
Ah, I see, there is also a wrapper/Move/CMakeOpenMM.txt
file that is presumably injected into the above file. This is the one that needs to be updated.