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Parallelized most of the sutff for contour finding and added a base class for these actions
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- regtest/crystallization/rt-wcsurface2/Makefile 1 addition, 0 deletionsregtest/crystallization/rt-wcsurface2/Makefile
- regtest/crystallization/rt-wcsurface2/analysis.0.contour2.dat.reference 219 additions, 0 deletions...llization/rt-wcsurface2/analysis.0.contour2.dat.reference
- regtest/crystallization/rt-wcsurface2/config 3 additions, 0 deletionsregtest/crystallization/rt-wcsurface2/config
- regtest/crystallization/rt-wcsurface2/contour2.dat.reference 219 additions, 0 deletionsregtest/crystallization/rt-wcsurface2/contour2.dat.reference
- regtest/crystallization/rt-wcsurface2/plumed.dat 7 additions, 0 deletionsregtest/crystallization/rt-wcsurface2/plumed.dat
- regtest/crystallization/rt-wcsurface2/traj-3frames.xyz 15558 additions, 0 deletionsregtest/crystallization/rt-wcsurface2/traj-3frames.xyz
- src/gridtools/ContourFindingBase.cpp 97 additions, 0 deletionssrc/gridtools/ContourFindingBase.cpp
- src/gridtools/ContourFindingBase.h 75 additions, 0 deletionssrc/gridtools/ContourFindingBase.h
- src/gridtools/FindContour.cpp 6 additions, 3 deletionssrc/gridtools/FindContour.cpp
- src/gridtools/FindContourSurface.cpp 221 additions, 0 deletionssrc/gridtools/FindContourSurface.cpp
- src/gridtools/FindSphericalContour.cpp 50 additions, 100 deletionssrc/gridtools/FindSphericalContour.cpp
- src/gridtools/GridFunction.cpp 7 additions, 2 deletionssrc/gridtools/GridFunction.cpp
- src/gridtools/GridFunction.h 2 additions, 0 deletionssrc/gridtools/GridFunction.h
- src/gridtools/GridVessel.h 7 additions, 0 deletionssrc/gridtools/GridVessel.h
- src/multicolvar/MultiColvarBase.cpp 1 addition, 1 deletionsrc/multicolvar/MultiColvarBase.cpp
- src/tools/Brent1DRootSearch.h 19 additions, 3 deletionssrc/tools/Brent1DRootSearch.h
- src/tools/Grid.cpp 1 addition, 1 deletionsrc/tools/Grid.cpp
- src/tools/Grid.h 1 addition, 1 deletionsrc/tools/Grid.h
- src/tools/MinimiseBase.h 12 additions, 6 deletionssrc/tools/MinimiseBase.h
- src/tools/RootFindingBase.h 23 additions, 6 deletionssrc/tools/RootFindingBase.h
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