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Made multicolvar and MultiColvarFunction inherit from a common base class
This makes these two classes slightly simpler. It also allows one to use MultiColvarFunctions on MultiColvarFunctions. We can thus do things like the value of the dot product of the q4 vector on a atom with the q4 vectors on the atoms in the first coordination sphere averaged over a subregion of the simulation box.
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- src/manyrestraints/Sphere.cpp 0 additions, 5 deletionssrc/manyrestraints/Sphere.cpp
- src/multicolvar/ActionVolume.cpp 29 additions, 14 deletionssrc/multicolvar/ActionVolume.cpp
- src/multicolvar/ActionVolume.h 4 additions, 11 deletionssrc/multicolvar/ActionVolume.h
- src/multicolvar/Angles.cpp 0 additions, 5 deletionssrc/multicolvar/Angles.cpp
- src/multicolvar/CoordinationNumbers.cpp 0 additions, 5 deletionssrc/multicolvar/CoordinationNumbers.cpp
- src/multicolvar/Density.cpp 0 additions, 1 deletionsrc/multicolvar/Density.cpp
- src/multicolvar/Distances.cpp 0 additions, 5 deletionssrc/multicolvar/Distances.cpp
- src/multicolvar/Moments.cpp 10 additions, 10 deletionssrc/multicolvar/Moments.cpp
- src/multicolvar/MultiColvar.cpp 38 additions, 208 deletionssrc/multicolvar/MultiColvar.cpp
- src/multicolvar/MultiColvar.h 20 additions, 194 deletionssrc/multicolvar/MultiColvar.h
- src/multicolvar/MultiColvarBase.cpp 221 additions, 0 deletionssrc/multicolvar/MultiColvarBase.cpp
- src/multicolvar/MultiColvarBase.h 228 additions, 0 deletionssrc/multicolvar/MultiColvarBase.h
- src/multicolvar/MultiColvarFunction.cpp 69 additions, 72 deletionssrc/multicolvar/MultiColvarFunction.cpp
- src/multicolvar/MultiColvarFunction.h 39 additions, 124 deletionssrc/multicolvar/MultiColvarFunction.h
- src/multicolvar/SecondaryStructureRMSD.cpp 0 additions, 4 deletionssrc/multicolvar/SecondaryStructureRMSD.cpp
- src/multicolvar/SecondaryStructureRMSD.h 0 additions, 1 deletionsrc/multicolvar/SecondaryStructureRMSD.h
- src/multicolvar/StoreCentralAtomsVessel.cpp 57 additions, 35 deletionssrc/multicolvar/StoreCentralAtomsVessel.cpp
- src/multicolvar/StoreCentralAtomsVessel.h 12 additions, 14 deletionssrc/multicolvar/StoreCentralAtomsVessel.h
- src/multicolvar/StoreColvarVessel.cpp 136 additions, 0 deletionssrc/multicolvar/StoreColvarVessel.cpp
- src/multicolvar/StoreColvarVessel.h 19 additions, 9 deletionssrc/multicolvar/StoreColvarVessel.h
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