Chemical Data Processing Library C++ API - Version 1.1.1
CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator Member List

This is the complete list of members for CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator, including all inherited members.

Atom3DCoordinatesFunction typedefCDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
AtomPairWeightFunction typedefCDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
calculate(const Chem::AtomContainer &cntnr, Math::DVector &descr)CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
getNumSteps() constCDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
getRadiusIncrement() constCDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
getStartRadius() constCDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
MoleculeAutoCorr3DDescriptorCalculator()CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
MoleculeAutoCorr3DDescriptorCalculator(const Chem::AtomContainer &cntnr, Math::DVector &descr)CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
setAtom3DCoordinatesFunction(const Atom3DCoordinatesFunction &func)CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
setAtomPairWeightFunction(const AtomPairWeightFunction &func)CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
setNumSteps(std::size_t num_steps)CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
setRadiusIncrement(double radius_inc)CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
setStartRadius(double start_radius)CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
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