gmx::anonymous_namespace{colvarsMDModule_stub.cpp}::ColvarsOptions Class Reference

Inheritance diagram for gmx::anonymous_namespace{colvarsMDModule_stub.cpp}::ColvarsOptions:

Collaboration diagram for gmx::anonymous_namespace{colvarsMDModule_stub.cpp}::ColvarsOptions:

Description

Colvars Options.

Stub Implementation in case Colvars library is not compiled

Public Member Functions
void	initMdpTransform (IKeyValueTreeTransformRules *) override
	Initializes a transform from mdp values to sectioned options. More...
void	buildMdpOutput (KeyValueTreeObjectBuilder *builder) const override
	Create Colvars mdp output even if Colvars is not compiled. This is to be consistent with the case where Colvars is compiled but not activated.
void	initMdpOptions (IOptionsContainerWithSections *) override
	Initializes options that declare input (mdp) parameters for this module.

Member Function Documentation

void gmx::anonymous_namespace{colvarsMDModule_stub.cpp}::ColvarsOptions::initMdpTransform ( IKeyValueTreeTransformRules *  transform )

inlineoverridevirtual

Initializes a transform from mdp values to sectioned options.

The transform is specified from a flat KeyValueTreeObject that contains each mdp value as a property, to a structured key-value tree that should match the options defined in initMdpOptions().

This method may be removed once the flat mdp file is replaced with a more structure input file (that can be directly read into the internal key-value tree), and there is no longer any need for backward compatibility with old files.

Implements gmx::IMdpOptionProvider.

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The documentation for this class was generated from the following file:

• src/gromacs/applied_forces/colvars/colvarsMDModule_stub.cpp