This class writes the results of a SFAM parametrization (parameters) to file. More...

Collaboration diagram for Scine::MMParametrization::ParameterFileWriter:

Static Public Member Functions
static void	writeSfamParametersToFile (const std::string &filename, const MolecularMechanics::SfamParameters &parameters, const Utils::Settings &settings)
	Writes MM parameters to a file and adds the parametrization settings to the header. More...

static void	writeSfamParametersToFile (const std::string &filename, const MolecularMechanics::SfamParameters &parameters)
	Writes MM parameters to a file. More...

static void	writeSfamParametersToFileImpl (std::ofstream &parFile, const MolecularMechanics::SfamParameters &parameters)

static std::string	generateAdditionalInformation (const Utils::Settings &settings)

Detailed Description

This class writes the results of a SFAM parametrization (parameters) to file.

Member Function Documentation

void Scine::MMParametrization::ParameterFileWriter::writeSfamParametersToFile	(	const std::string &	filename,
		const MolecularMechanics::SfamParameters &	parameters,
		const Utils::Settings &	settings
	)

static

Writes MM parameters to a file and adds the parametrization settings to the header.

Parameters

filename	Name of the file to which the MM parameters are written.
parameters	The MM parameters.
settings	The settings.

void Scine::MMParametrization::ParameterFileWriter::writeSfamParametersToFile	(	const std::string &	filename,
		const MolecularMechanics::SfamParameters &	parameters
	)

static

Writes MM parameters to a file.

Parameters

filename	Name of the file to which the MM parameters are written.
parameters	The MM parameters.

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

src/Swoose/Swoose/MMParametrization/ParametrizationUtils/ParameterFileWriter.h
src/Swoose/Swoose/MMParametrization/ParametrizationUtils/ParameterFileWriter.cpp