Chemical Data Processing Library C++ API - Version 1.1.1
CDPL::ConfGen::StructureGeneratorSettings Member List

This is the complete list of members for CDPL::ConfGen::StructureGeneratorSettings, including all inherited members.

DEFAULTCDPL::ConfGen::StructureGeneratorSettingsstatic
generateCoordinatesFromScratch(bool generate)CDPL::ConfGen::StructureGeneratorSettings
generateCoordinatesFromScratch() constCDPL::ConfGen::StructureGeneratorSettings
getConvergenceCheckCycleSize() constCDPL::ConfGen::StructureGeneratorSettings
getDGModeForceFieldType() constCDPL::ConfGen::StructureGeneratorSettings
getDielectricConstant() constCDPL::ConfGen::StructureGeneratorSettings
getDistanceExponent() constCDPL::ConfGen::StructureGeneratorSettings
getFragmentBuildSettings()CDPL::ConfGen::StructureGeneratorSettings
getFragmentBuildSettings() constCDPL::ConfGen::StructureGeneratorSettings
getFragmentModeForceFieldType() constCDPL::ConfGen::StructureGeneratorSettings
getGenerationMode() constCDPL::ConfGen::StructureGeneratorSettings
getMacrocycleRotorBondCountThreshold() constCDPL::ConfGen::StructureGeneratorSettings
getMaxNumRefinementIterations() constCDPL::ConfGen::StructureGeneratorSettings
getMaxNumSampledConformers() constCDPL::ConfGen::StructureGeneratorSettings
getRefinementTolerance() constCDPL::ConfGen::StructureGeneratorSettings
getTimeout() constCDPL::ConfGen::StructureGeneratorSettings
sampleAngleToleranceRanges(bool sample)CDPL::ConfGen::StructureGeneratorSettings
sampleAngleToleranceRanges() constCDPL::ConfGen::StructureGeneratorSettings
setConvergenceCheckCycleSize(std::size_t size)CDPL::ConfGen::StructureGeneratorSettings
setDGModeForceFieldType(unsigned int type)CDPL::ConfGen::StructureGeneratorSettings
setDielectricConstant(double de_const)CDPL::ConfGen::StructureGeneratorSettings
setDistanceExponent(double exponent)CDPL::ConfGen::StructureGeneratorSettings
setFragmentModeForceFieldType(unsigned int type)CDPL::ConfGen::StructureGeneratorSettings
setGenerationMode(unsigned int mode)CDPL::ConfGen::StructureGeneratorSettings
setMacrocycleRotorBondCountThreshold(std::size_t min_count)CDPL::ConfGen::StructureGeneratorSettings
setMaxNumRefinementIterations(std::size_t max_iter)CDPL::ConfGen::StructureGeneratorSettings
setMaxNumSampledConformers(std::size_t max_num)CDPL::ConfGen::StructureGeneratorSettings
setRefinementTolerance(double tol)CDPL::ConfGen::StructureGeneratorSettings
setTimeout(std::size_t mil_secs)CDPL::ConfGen::StructureGeneratorSettings
strictForceFieldParameterization(bool strict)CDPL::ConfGen::StructureGeneratorSettings
strictForceFieldParameterization() constCDPL::ConfGen::StructureGeneratorSettings
StructureGeneratorSettings()CDPL::ConfGen::StructureGeneratorSettings