Chemical Data Processing Library C++ API - Version 1.1.1
Public Member Functions | Static Public Attributes | List of all members
CDPL::ConfGen::FragmentAssemblerSettings Class Reference

#include <FragmentAssemblerSettings.hpp>

Public Member Functions

 FragmentAssemblerSettings ()
 
void enumerateRings (bool enumerate)
 
bool enumerateRings () const
 
void setNitrogenEnumerationMode (unsigned int mode)
 
unsigned int getNitrogenEnumerationMode () const
 
void generateCoordinatesFromScratch (bool generate)
 
bool generateCoordinatesFromScratch () const
 
FragmentConformerGeneratorSettingsgetFragmentBuildSettings ()
 
const FragmentConformerGeneratorSettingsgetFragmentBuildSettings () const
 

Static Public Attributes

static const FragmentAssemblerSettings DEFAULT
 

Constructor & Destructor Documentation

◆ FragmentAssemblerSettings()

CDPL::ConfGen::FragmentAssemblerSettings::FragmentAssemblerSettings ( )

Member Function Documentation

◆ enumerateRings() [1/2]

void CDPL::ConfGen::FragmentAssemblerSettings::enumerateRings ( bool  enumerate)

◆ enumerateRings() [2/2]

bool CDPL::ConfGen::FragmentAssemblerSettings::enumerateRings ( ) const

◆ setNitrogenEnumerationMode()

void CDPL::ConfGen::FragmentAssemblerSettings::setNitrogenEnumerationMode ( unsigned int  mode)

◆ getNitrogenEnumerationMode()

unsigned int CDPL::ConfGen::FragmentAssemblerSettings::getNitrogenEnumerationMode ( ) const

◆ generateCoordinatesFromScratch() [1/2]

void CDPL::ConfGen::FragmentAssemblerSettings::generateCoordinatesFromScratch ( bool  generate)

◆ generateCoordinatesFromScratch() [2/2]

bool CDPL::ConfGen::FragmentAssemblerSettings::generateCoordinatesFromScratch ( ) const

◆ getFragmentBuildSettings() [1/2]

FragmentConformerGeneratorSettings& CDPL::ConfGen::FragmentAssemblerSettings::getFragmentBuildSettings ( )

◆ getFragmentBuildSettings() [2/2]

const FragmentConformerGeneratorSettings& CDPL::ConfGen::FragmentAssemblerSettings::getFragmentBuildSettings ( ) const

Member Data Documentation

◆ DEFAULT

const FragmentAssemblerSettings CDPL::ConfGen::FragmentAssemblerSettings::DEFAULT
static

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