AtomDensityGridCalculator() | CDPL::GRAIL::AtomDensityGridCalculator | |
AtomDensityGridCalculator(const AtomDensityGridCalculator &calc) | CDPL::GRAIL::AtomDensityGridCalculator | |
AtomDensityGridCalculator(const DensityFunction &func) | CDPL::GRAIL::AtomDensityGridCalculator | |
AtomDensityGridCalculator(const DensityFunction &density_func, const DensityCombinationFunction &comb_func) | CDPL::GRAIL::AtomDensityGridCalculator | |
calculate(const Chem::AtomContainer &atoms, Grid::DSpatialGrid &grid) | CDPL::GRAIL::AtomDensityGridCalculator | |
DEF_DISTANCE_CUTOFF | CDPL::GRAIL::AtomDensityGridCalculator | static |
DensityCombinationFunction typedef | CDPL::GRAIL::AtomDensityGridCalculator | |
DensityFunction typedef | CDPL::GRAIL::AtomDensityGridCalculator | |
getAtom3DCoordinatesFunction() const | CDPL::GRAIL::AtomDensityGridCalculator | |
getDensityCombinationFunction() const | CDPL::GRAIL::AtomDensityGridCalculator | |
getDensityFunction() const | CDPL::GRAIL::AtomDensityGridCalculator | |
getDistanceCutoff() const | CDPL::GRAIL::AtomDensityGridCalculator | |
operator=(const AtomDensityGridCalculator &calc) | CDPL::GRAIL::AtomDensityGridCalculator | |
setAtom3DCoordinatesFunction(const Chem::Atom3DCoordinatesFunction &func) | CDPL::GRAIL::AtomDensityGridCalculator | |
setDensityCombinationFunction(const DensityCombinationFunction &func) | CDPL::GRAIL::AtomDensityGridCalculator | |
setDensityFunction(const DensityFunction &func) | CDPL::GRAIL::AtomDensityGridCalculator | |
setDistanceCutoff(double dist) | CDPL::GRAIL::AtomDensityGridCalculator | |
SharedPointer typedef | CDPL::GRAIL::AtomDensityGridCalculator | |