Gromacs
2026.0-dev-20241204-d69d709
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Directories | |
directory | tests |
Files | |
file | colvarproxy_gromacs_version.h |
Tracks the Colvars GROMACS interface version; see https://github.com/Colvars/colvars. | |
file | colvarproxygromacs.cpp |
Implements the Colvars GROMACS proxy class. | |
file | colvarproxygromacs.h |
Declares the Colvars GROMACS proxy class. | |
file | colvarsforceprovider.cpp |
Implements the force provider for colvars. | |
file | colvarsforceprovider.h |
Declares the force provider for colvars. | |
file | colvarsMDModule.cpp |
Implements Colvars MDModule class. | |
file | colvarsMDModule.h |
Declares factory structure for Colvars MDModule class. | |
file | colvarsMDModule_stub.cpp |
Stub implementation of ColvarsMDModule Compiled in case if Colvars is not activated with CMake. | |
file | colvarsoptions.cpp |
Implements options for Colvars. Keep a minimal ColvarsOptions implementation in the case Colvars is not activated to ensure compatbility (with gmx tools for example). | |
file | colvarsoptions.h |
Declares options for Colvars. This class handles parameters set during pre-processing time. | |
file | colvarspreprocessor.cpp |
Implements the Colvars GROMACS proxy class during pre-processing. | |
file | colvarspreprocessor.h |
Declares the Colvars GROMACS proxy class during pre-processing. | |
file | colvarssimulationsparameters.cpp |
Implements the class holding parameters needed during simulation time. | |
file | colvarssimulationsparameters.h |
Declares parameters needed during simulation time. | |