GaussianShapeGenerator() | CDPL::Shape::GaussianShapeGenerator | |
generate(const Chem::MolecularGraph &molgraph) | CDPL::Shape::GaussianShapeGenerator | |
generateMoleculeShape(bool generate) | CDPL::Shape::GaussianShapeGenerator | |
generateMoleculeShape() const | CDPL::Shape::GaussianShapeGenerator | |
generatePharmacophoreShape(bool generate) | CDPL::Shape::GaussianShapeGenerator | |
generatePharmacophoreShape() const | CDPL::Shape::GaussianShapeGenerator | |
getAtomHardness() | CDPL::Shape::GaussianShapeGenerator | |
getAtomRadius() const | CDPL::Shape::GaussianShapeGenerator | |
getDefaultPharmacophoreGenerator() const | CDPL::Shape::GaussianShapeGenerator | |
getDefaultPharmacophoreGenerator() | CDPL::Shape::GaussianShapeGenerator | |
getFeatureHardness() | CDPL::Shape::GaussianShapeGenerator | |
getFeatureRadius() const | CDPL::Shape::GaussianShapeGenerator | |
getPharmacophoreGenerator() const | CDPL::Shape::GaussianShapeGenerator | |
getShapes() const | CDPL::Shape::GaussianShapeGenerator | |
includeHydrogens(bool include) | CDPL::Shape::GaussianShapeGenerator | |
includeHydrogens() const | CDPL::Shape::GaussianShapeGenerator | |
multiConformerMode(bool multi_conf) | CDPL::Shape::GaussianShapeGenerator | |
multiConformerMode() const | CDPL::Shape::GaussianShapeGenerator | |
setAtomHardness(double hardness) | CDPL::Shape::GaussianShapeGenerator | |
setAtomRadius(double radius) | CDPL::Shape::GaussianShapeGenerator | |
setFeatureHardness(double hardness) | CDPL::Shape::GaussianShapeGenerator | |
setFeatureRadius(double radius) | CDPL::Shape::GaussianShapeGenerator | |
setPharmacophoreGenerator(Pharm::PharmacophoreGenerator &gen) | CDPL::Shape::GaussianShapeGenerator | |
SharedPointer typedef | CDPL::Shape::GaussianShapeGenerator | |