votca::xtp::XtpApplication Class Reference

#include <xtpapplication.h>

Inheritance diagram for votca::xtp::XtpApplication:

Collaboration diagram for votca::xtp::XtpApplication:

Public Member Functions
	XtpApplication ()
	~XtpApplication () override
void	Initialize () final
	Adds program options to the executable.
bool	EvaluateOptions () final
	Process command line options.
void	Run () final
	Main body of application.
void	ShowHelpText (std::ostream &out) final
Public Member Functions inherited from votca::tools::Application
	Application ()
virtual	~Application ()
int	Exec (int argc, char **argv)
	executes the program
virtual std::string	ProgramName ()=0
	program name
virtual std::string	VersionString ()
	version string of application
virtual void	HelpText (std::ostream &out)=0
	help text of application without version information
void	CheckRequired (const std::string &option_name, const std::string &error_msg="")
	Check weather required option is set.
boost::program_options::options_description_easy_init	AddProgramOptions (const std::string &group="")
	add option for command line
boost::program_options::variables_map &	OptionsMap ()
	get available program options & descriptions
boost::program_options::options_description &	OptionsDesc ()
boost::program_options::options_description &	VisibleOptions ()
	filters out the Hidden group from the options descriptions
void	StopExecution ()
	call StopExecution after EvaluateOptions

Protected Member Functions
virtual void	execute ()=0
virtual std::string	CalculatorType () const =0
virtual void	EvaluateSpecificOptions ()=0
virtual std::vector< std::string >	CalculatorNames () const =0
virtual void	CreateCalculator (const std::string &name)=0
virtual void	AddCommandLineOptions ()=0
Protected Member Functions inherited from votca::tools::Application

Protected Attributes
votca::tools::Property	options_
Protected Attributes inherited from votca::tools::Application
std::map< std::string, boost::program_options::options_description >	op_groups_
bool	continue_execution_ = true

Private Member Functions
void	PrintShortHelp (std::ostream &out, const std::string &calculator_name) const
void	PrintLongHelp (std::ostream &out, const std::string &calculator_name, tools::PropertyIOManipulator::Type format) const
bool	CalcExists (const std::string &name) const

Detailed Description

Definition at line 34 of file xtpapplication.h.

Constructor & Destructor Documentation

XtpApplication()

votca::xtp::XtpApplication::XtpApplication ( )

default

~XtpApplication()

votca::xtp::XtpApplication::~XtpApplication ( )

overridedefault

Member Function Documentation

AddCommandLineOptions()

virtual void votca::xtp::XtpApplication::AddCommandLineOptions ( )

protectedpure virtual

Implemented in votca::xtp::StateApplication, and XtpTools.

CalcExists()

bool votca::xtp::XtpApplication::CalcExists ( const std::string & name ) const

inlineprivate

Definition at line 65 of file xtpapplication.h.

CalculatorNames()

virtual std::vector< std::string > votca::xtp::XtpApplication::CalculatorNames ( ) const

protectedpure virtual

Implemented in XtpParallel, XtpRun, and XtpTools.

CalculatorType()

virtual std::string votca::xtp::XtpApplication::CalculatorType ( ) const

protectedpure virtual

Implemented in XtpParallel, XtpRun, and XtpTools.

CreateCalculator()

virtual void votca::xtp::XtpApplication::CreateCalculator ( const std::string & name )

protectedpure virtual

Implemented in XtpParallel, XtpRun, and XtpTools.

EvaluateOptions()

bool votca::xtp::XtpApplication::EvaluateOptions ( )

finalvirtual

Process command line options.

Returns

true to continue, false to stop

EvaluateOptions is called by Run after parsing the command line. return true if everything is ok, false to stop and show help text.

Implements votca::tools::Application.

Definition at line 88 of file xtpapplication.cc.

EvaluateSpecificOptions()

virtual void votca::xtp::XtpApplication::EvaluateSpecificOptions ( )

protectedpure virtual

Implemented in votca::xtp::StateApplication, and XtpTools.

execute()

virtual void votca::xtp::XtpApplication::execute ( )

protectedpure virtual

Implemented in votca::xtp::StateApplication, and XtpTools.

Initialize()

void votca::xtp::XtpApplication::Initialize ( void )

finalvirtual

Adds program options to the executable.

Every executable requires option file for calculators it is running It is thus a part of the base XtpApplication class

Implements votca::tools::Application.

Definition at line 51 of file xtpapplication.cc.

PrintLongHelp()

void votca::xtp::XtpApplication::PrintLongHelp ( std::ostream & out, const std::string & calculator_name, tools::PropertyIOManipulator::Type format ) const

private

Definition at line 221 of file xtpapplication.cc.

PrintShortHelp()

void votca::xtp::XtpApplication::PrintShortHelp ( std::ostream & out, const std::string & calculator_name ) const

private

Definition at line 208 of file xtpapplication.cc.

Run()

void votca::xtp::XtpApplication::Run ( )

finalvirtual

Main body of application.

Run is called after command line was parsed + evaluated. All the work should be done in here.

Implements votca::tools::Application.

Definition at line 187 of file xtpapplication.cc.

ShowHelpText()

void votca::xtp::XtpApplication::ShowHelpText ( std::ostream & out )

finalvirtual

Reimplemented from votca::tools::Application.

Definition at line 198 of file xtpapplication.cc.

Member Data Documentation

options_

votca::tools::Property votca::xtp::XtpApplication::options_

protected

Definition at line 56 of file xtpapplication.h.

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

• xtp/include/votca/xtp/xtpapplication.h
• xtp/src/libxtp/xtpapplication.cc