Chemical Data Processing Library C++ API - Version 1.2.0
CDPL::GRAIL::BuriednessGridCalculator Member List

This is the complete list of members for CDPL::GRAIL::BuriednessGridCalculator, including all inherited members.

BuriednessGridCalculator()CDPL::GRAIL::BuriednessGridCalculator
BuriednessGridCalculator(const BuriednessGridCalculator &calc)CDPL::GRAIL::BuriednessGridCalculator
calculate(const Chem::AtomContainer &atoms, Grid::DSpatialGrid &grid)CDPL::GRAIL::BuriednessGridCalculator
getAtom3DCoordinatesFunction() constCDPL::GRAIL::BuriednessGridCalculator
getMinVdWSurfaceDistance() constCDPL::GRAIL::BuriednessGridCalculator
getNumTestRays() constCDPL::GRAIL::BuriednessGridCalculator
getProbeRadius() constCDPL::GRAIL::BuriednessGridCalculator
operator=(const BuriednessGridCalculator &calc)CDPL::GRAIL::BuriednessGridCalculator
setAtom3DCoordinatesFunction(const Chem::Atom3DCoordinatesFunction &func)CDPL::GRAIL::BuriednessGridCalculator
setMinVdWSurfaceDistance(double dist)CDPL::GRAIL::BuriednessGridCalculator
setNumTestRays(std::size_t num_rays)CDPL::GRAIL::BuriednessGridCalculator
setProbeRadius(double radius)CDPL::GRAIL::BuriednessGridCalculator
SharedPointer typedefCDPL::GRAIL::BuriednessGridCalculator
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