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Removed calculation of derivatives when not required
This functionality is not complete. In multicolvar this is done correctly. However, for normal colvars and the like derivatives are still calculated even when they are not required
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- src/bias/Bias.cpp 7 additions, 0 deletionssrc/bias/Bias.cpp
- src/bias/Bias.h 7 additions, 0 deletionssrc/bias/Bias.h
- src/colvar/Energy.cpp 5 additions, 0 deletionssrc/colvar/Energy.cpp
- src/core/ActionAtomistic.cpp 1 addition, 1 deletionsrc/core/ActionAtomistic.cpp
- src/core/ActionWithArguments.cpp 1 addition, 1 deletionsrc/core/ActionWithArguments.cpp
- src/core/ActionWithValue.cpp 13 additions, 8 deletionssrc/core/ActionWithValue.cpp
- src/core/ActionWithValue.h 9 additions, 5 deletionssrc/core/ActionWithValue.h
- src/core/Colvar.h 6 additions, 0 deletionssrc/core/Colvar.h
- src/core/Value.cpp 1 addition, 1 deletionsrc/core/Value.cpp
- src/core/Value.h 1 addition, 1 deletionsrc/core/Value.h
- src/crystallization/StoreVectorsVessel.cpp 7 additions, 3 deletionssrc/crystallization/StoreVectorsVessel.cpp
- src/crystallization/VectorAverage.cpp 6 additions, 0 deletionssrc/crystallization/VectorAverage.cpp
- src/crystallization/VectorMultiColvar.cpp 24 additions, 23 deletionssrc/crystallization/VectorMultiColvar.cpp
- src/function/Function.h 6 additions, 0 deletionssrc/function/Function.h
- src/generic/DumpDerivatives.cpp 3 additions, 0 deletionssrc/generic/DumpDerivatives.cpp
- src/generic/DumpProjections.cpp 5 additions, 0 deletionssrc/generic/DumpProjections.cpp
- src/generic/Read.cpp 10 additions, 0 deletionssrc/generic/Read.cpp
- src/generic/Time.cpp 1 addition, 0 deletionssrc/generic/Time.cpp
- src/manyrestraints/ManyRestraintsBase.cpp 4 additions, 0 deletionssrc/manyrestraints/ManyRestraintsBase.cpp
- src/manyrestraints/ManyRestraintsBase.h 1 addition, 0 deletionssrc/manyrestraints/ManyRestraintsBase.h
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