Here is a list of all class members with links to the classes they belong to:

- a -

• abs() : CDPL::Math::ComplexTraits< T > , CDPL::Math::ScalarAbsImpl< Signed > , CDPL::Math::ScalarAbsImpl< false > , CDPL::Math::ScalarTraits< T >
• ACCEPTOR : CDPL::ForceField::MMFF94VanDerWaalsInteraction
• AccessorType : CDPL::Math::VectorIteratorTraits< E > , CDPL::Math::VectorIteratorTraits< const E >
• add14DistanceConstraints() : CDPL::ConfGen::DGConstraintGenerator
• addAngle() : CDPL::ConfGen::TorsionRule
• addAtom() : CDPL::Chem::BasicMolecule , CDPL::Chem::ElectronSystem , CDPL::Chem::Fragment , CDPL::Chem::Molecule
• addAtomConfigurationConstraints() : CDPL::ConfGen::DGConstraintGenerator
• addAtomMappingConstraint() : CDPL::Chem::AutomorphismGroupSearch , CDPL::Chem::SubstructureSearch
• addAtomPlanarityConstraints() : CDPL::ConfGen::DGConstraintGenerator
• addAtoms() : CDPL::Chem::ElectronSystem
• addAtomStereoCenter() : CDPL::ConfGen::DGConstraintGenerator
• addBond() : CDPL::Chem::BasicMolecule , CDPL::Chem::Fragment , CDPL::Chem::Molecule
• addBondAngleConstraints() : CDPL::ConfGen::DGConstraintGenerator
• addBondConfigurationConstraints() : CDPL::ConfGen::DGConstraintGenerator
• addBondLengthConstraints() : CDPL::ConfGen::DGConstraintGenerator
• addBondMappingConstraint() : CDPL::Chem::AutomorphismGroupSearch , CDPL::Chem::SubstructureSearch
• addBondPlanarityConstraints() : CDPL::ConfGen::DGConstraintGenerator
• addBondStereoCenter() : CDPL::ConfGen::DGConstraintGenerator
• addCategory() : CDPL::ConfGen::TorsionCategory
• addComponent() : CDPL::Chem::BasicReaction , CDPL::Chem::Reaction
• addConformation() : CDPL::Chem::DefaultMultiConfMoleculeInputProcessor , CDPL::Chem::MultiConfMoleculeInputProcessor
• addConformer() : CDPL::ConfGen::FragmentLibraryEntry
• addDefaultDistanceConstraints() : CDPL::ConfGen::DGConstraintGenerator
• addDistanceConstraint() : CDPL::Util::DGCoordinatesGeneratorBase< Dim, T, Derived >
• addElement() : CDPL::Chem::MatchConstraintList , CDPL::Shape::GaussianShape , CDPL::Util::Array< ValueType >
• addEllipse() : CDPL::Vis::Path2D
• addEnergyWindowRange() : CDPL::ConfGen::ConformerGeneratorSettings
• addEntity() : CDPL::Chem::SpatialEntityAlignment< T > , CDPL::Chem::TopologicalEntityAlignment< T >
• addEntries() : CDPL::ConfGen::FragmentLibrary
• addEntry() : CDPL::Biomol::ResidueDictionary , CDPL::Chem::AtomDictionary , CDPL::Chem::StringDataBlock , CDPL::ConfGen::FragmentLibrary , CDPL::ForceField::MMFF94AngleBendingParameterTable , CDPL::ForceField::MMFF94AromaticAtomTypeDefinitionTable , CDPL::ForceField::MMFF94AtomTypePropertyTable , CDPL::ForceField::MMFF94BondChargeIncrementTable , CDPL::ForceField::MMFF94BondStretchingParameterTable , CDPL::ForceField::MMFF94BondStretchingRuleParameterTable , CDPL::ForceField::MMFF94DefaultStretchBendParameterTable , CDPL::ForceField::MMFF94FormalAtomChargeDefinitionTable , CDPL::ForceField::MMFF94HeavyToHydrogenAtomTypeMap , CDPL::ForceField::MMFF94OutOfPlaneBendingParameterTable , CDPL::ForceField::MMFF94PartialBondChargeIncrementTable , CDPL::ForceField::MMFF94PrimaryToParameterAtomTypeMap , CDPL::ForceField::MMFF94StretchBendParameterTable , CDPL::ForceField::MMFF94SymbolicAtomTypePatternTable , CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap , CDPL::ForceField::MMFF94TorsionParameterTable , CDPL::ForceField::MMFF94VanDerWaalsParameterTable , CDPL::ForceField::UFFAtomTypePropertyTable
• addExcludePattern() : CDPL::Chem::FragmentGenerator , CDPL::Chem::PatternBasedTautomerizationRule , CDPL::Pharm::PatternBasedFeatureGenerator
• addExcludePatterns() : CDPL::Chem::PatternBasedTautomerizationRule
• addExclusionVolumes() : CDPL::Pharm::InteractionPharmacophoreGenerator
• addFeature() : CDPL::Pharm::BasicPharmacophore , CDPL::Pharm::FeatureSet , CDPL::Pharm::Pharmacophore
• addFeatures() : CDPL::Pharm::PharmacophoreAlignment
• addFileExtension() : CDPL::Base::DataFormat
• addFixedSubstructureConstraints() : CDPL::ConfGen::DGConstraintGenerator
• addFragmentationRule() : CDPL::Chem::FragmentGenerator
• addFragmentLibrary() : CDPL::ConfGen::ConformerGenerator , CDPL::ConfGen::FragmentAssembler , CDPL::ConfGen::StructureGenerator
• addIncludePattern() : CDPL::Pharm::PatternBasedFeatureGenerator
• addInputCoordinates() : CDPL::ConfGen::TorsionDriver
• addMargin() : CDPL::Vis::Rectangle2D
• addMaxNumOutputConformersRange() : CDPL::ConfGen::ConformerGeneratorSettings
• addMinRMSDRange() : CDPL::ConfGen::ConformerGeneratorSettings
• addNonPatternFeatures() : CDPL::Pharm::PatternBasedFeatureGenerator
• addParameters() : CDPL::Base::ControlParameterContainer
• addPattern() : CDPL::Chem::PatternAtomTyper , CDPL::Chem::SubstructureHistogramCalculator
• addPoint() : CDPL::Vis::Rectangle2D
• addProperties() : CDPL::Base::PropertyContainer
• addQuery() : CDPL::Shape::ScreeningProcessor
• addReader() : CDPL::Util::CompoundDataReader< DataType >
• addRectangle() : CDPL::Vis::Path2D , CDPL::Vis::Rectangle2D
• addReferenceShape() : CDPL::Shape::FastGaussianShapeAlignment , CDPL::Shape::GaussianShapeAlignment
• addReferenceShapes() : CDPL::Shape::FastGaussianShapeAlignment , CDPL::Shape::GaussianShapeAlignment
• addRule() : CDPL::ConfGen::TorsionCategory
• addTautomerizationRule() : CDPL::Chem::TautomerGenerator
• addTorsionLibrary() : CDPL::ConfGen::ConformerGenerator , CDPL::ConfGen::StructureGenerator , CDPL::ConfGen::TorsionDriver
• addTransformationPattern() : CDPL::Chem::PatternBasedTautomerizationRule
• addVolumeConstraint() : CDPL::Util::DGCoordinatesGenerator< 3, T >
• addXYData() : CDPL::Math::MLRModel< T >
• AffinityMeasure : CDPL::GRAIL::BindingAffinityCalculator
• align() : CDPL::Math::KabschAlgorithm< T > , CDPL::Shape::FastGaussianShapeAlignment , CDPL::Shape::GaussianShapeAlignment , CDPL::Shape::GaussianShapeFunctionAlignment
• AlignedColorTverskyScore() : CDPL::Shape::AlignedColorTverskyScore
• AlignedShapeTverskyScore() : CDPL::Shape::AlignedShapeTverskyScore
• AlignedTotalOverlapTverskyScore() : CDPL::Shape::AlignedTotalOverlapTverskyScore
• AlignedTverskyComboScore() : CDPL::Shape::AlignedTverskyComboScore
• alignHitMolecule() : CDPL::Pharm::FileScreeningHitCollector
• AlignmentMode : CDPL::Shape::ScreeningSettings
• AlignmentResult() : CDPL::Shape::AlignmentResult
• ALL_MATCHING_CONFS : CDPL::Pharm::ScreeningProcessor
• allCarbonMode() : CDPL::Shape::ScreeningSettings
• allowDuplicateEntries() : CDPL::Pharm::PSDScreeningDBCreator , CDPL::Pharm::ScreeningDBCreator
• AmideImidicAcidTautomerization() : CDPL::Chem::AmideImidicAcidTautomerization
• analyze() : CDPL::Chem::BemisMurckoAnalyzer , CDPL::Pharm::InteractionAnalyzer
• AND_LIST : CDPL::Chem::MatchConstraintList
• angle : CDPL::Chem::Atom2DCoordinatesCalculator::LGNode::NodeLayoutInfo
• AngleEntry() : CDPL::ConfGen::TorsionRule::AngleEntry
• AngleEntryIterator : CDPL::ConfGen::TorsionRule
• AngleScoringFunction : CDPL::Pharm::CationPiInteractionScore , CDPL::Pharm::HBondingInteractionScore , CDPL::Pharm::OrthogonalPiPiInteractionScore , CDPL::Pharm::ParallelPiPiInteractionScore , CDPL::Pharm::XBondingInteractionScore
• Any() : CDPL::Base::Any
• ANY : CDPL::Chem::MatchConstraint
• append() : CDPL::Chem::BasicMolecule , CDPL::Chem::Molecule , CDPL::Pharm::BasicPharmacophore , CDPL::Pharm::Pharmacophore
• APPEND : CDPL::Pharm::ScreeningDBCreator
• apply() : CDPL::Math::CrossProductMatrixFromVector< V > , CDPL::Math::DiagonalMatrixFromVector< V > , CDPL::Math::GridElementSum< G > , CDPL::Math::GridEquality< G1, G2 > , CDPL::Math::GridToleranceEquality< G1, G2, T > , CDPL::Math::MatrixElementSum< M > , CDPL::Math::MatrixEquality< M1, M2 > , CDPL::Math::MatrixNorm1< M > , CDPL::Math::MatrixNormFrobenius< M > , CDPL::Math::MatrixNormInfinity< M > , CDPL::Math::MatrixProduct< M1, M2 > , CDPL::Math::MatrixToleranceEquality< M1, M2, T > , CDPL::Math::MatrixTrace< M > , CDPL::Math::MatrixVectorProduct< M, V > , CDPL::Math::QuaternionElementSum< Q > , CDPL::Math::QuaternionEquality< Q1, Q2 > , CDPL::Math::QuaternionNorm2< Q > , CDPL::Math::QuaternionNorm< Q > , CDPL::Math::QuaternionToleranceEquality< Q1, Q2, T > , CDPL::Math::QuaternionVectorRotation< Q, V > , CDPL::Math::ScalarAddition< T1, T2 > , CDPL::Math::ScalarAdditionAssignment< T1, T2 > , CDPL::Math::ScalarAssignment< T1, T2 > , CDPL::Math::ScalarConjugation< T > , CDPL::Math::ScalarDivision< T1, T2 > , CDPL::Math::ScalarDivisionAssignment< T1, T2 > , CDPL::Math::ScalarImaginary< T > , CDPL::Math::ScalarMultiplication< T1, T2 > , CDPL::Math::ScalarMultiplicationAssignment< T1, T2 > , CDPL::Math::ScalarNegation< T > , CDPL::Math::ScalarReal< T > , CDPL::Math::ScalarSubtraction< T1, T2 > , CDPL::Math::ScalarSubtractionAssignment< T1, T2 > , CDPL::Math::VectorAngleCosine< V1, V2, T > , CDPL::Math::VectorCrossProduct< V1, V2 > , CDPL::Math::VectorElementSum< V > , CDPL::Math::VectorEquality< V1, V2 > , CDPL::Math::VectorInnerProduct< V1, V2 > , CDPL::Math::VectorMatrixProduct< V, M > , CDPL::Math::VectorNorm1< V > , CDPL::Math::VectorNorm2< V > , CDPL::Math::VectorNormInfinity< V > , CDPL::Math::VectorNormInfinityIndex< V > , CDPL::Math::VectorToleranceEquality< V1, V2, T >
• applyC1() : CDPL::Math::QuaternionConjugate< Q > , CDPL::Math::QuaternionDivision< Q1, Q2, T > , CDPL::Math::QuaternionInverse< Q, T > , CDPL::Math::QuaternionProduct< Q1, Q2 > , CDPL::Math::QuaternionUnreal< Q > , CDPL::Math::Scalar1QuaternionAddition< T, Q > , CDPL::Math::Scalar1QuaternionSubtraction< T, Q > , CDPL::Math::Scalar2QuaternionAddition< Q, T > , CDPL::Math::Scalar2QuaternionSubtraction< Q, T > , CDPL::Math::ScalarQuaternionDivision< T1, Q, T2 >
• applyC2() : CDPL::Math::QuaternionConjugate< Q > , CDPL::Math::QuaternionDivision< Q1, Q2, T > , CDPL::Math::QuaternionInverse< Q, T > , CDPL::Math::QuaternionProduct< Q1, Q2 > , CDPL::Math::QuaternionUnreal< Q > , CDPL::Math::Scalar1QuaternionAddition< T, Q > , CDPL::Math::Scalar1QuaternionSubtraction< T, Q > , CDPL::Math::Scalar2QuaternionAddition< Q, T > , CDPL::Math::Scalar2QuaternionSubtraction< Q, T > , CDPL::Math::ScalarQuaternionDivision< T1, Q, T2 >
• applyC3() : CDPL::Math::QuaternionConjugate< Q > , CDPL::Math::QuaternionDivision< Q1, Q2, T > , CDPL::Math::QuaternionInverse< Q, T > , CDPL::Math::QuaternionProduct< Q1, Q2 > , CDPL::Math::QuaternionUnreal< Q > , CDPL::Math::Scalar1QuaternionAddition< T, Q > , CDPL::Math::Scalar1QuaternionSubtraction< T, Q > , CDPL::Math::Scalar2QuaternionAddition< Q, T > , CDPL::Math::Scalar2QuaternionSubtraction< Q, T > , CDPL::Math::ScalarQuaternionDivision< T1, Q, T2 >
• applyC4() : CDPL::Math::QuaternionConjugate< Q > , CDPL::Math::QuaternionDivision< Q1, Q2, T > , CDPL::Math::QuaternionInverse< Q, T > , CDPL::Math::QuaternionProduct< Q1, Q2 > , CDPL::Math::QuaternionUnreal< Q > , CDPL::Math::Scalar1QuaternionAddition< T, Q > , CDPL::Math::Scalar1QuaternionSubtraction< T, Q > , CDPL::Math::Scalar2QuaternionAddition< Q, T > , CDPL::Math::Scalar2QuaternionSubtraction< Q, T > , CDPL::Math::ScalarQuaternionDivision< T1, Q, T2 >
• applyConfiguration() : CDPL::Pharm::DefaultPharmacophoreGenerator
• AR_AR_SCORE_MAX : CDPL::GRAIL::GRAILDescriptorCalculator , CDPL::GRAIL::GRAILXDescriptorCalculator
• AR_AR_SCORE_SUM : CDPL::GRAIL::GRAILDescriptorCalculator , CDPL::GRAIL::GRAILXDescriptorCalculator
• AR_COUNT : CDPL::GRAIL::GRAILDescriptorCalculator , CDPL::GRAIL::GRAILXDescriptorCalculator
• AR_PI_SCORE_MAX : CDPL::GRAIL::GRAILDescriptorCalculator , CDPL::GRAIL::GRAILXDescriptorCalculator
• AR_PI_SCORE_SUM : CDPL::GRAIL::GRAILDescriptorCalculator , CDPL::GRAIL::GRAILXDescriptorCalculator
• arc() : CDPL::Vis::Path2D
• arcTo() : CDPL::Vis::Path2D , CDPL::Vis::Path2DConverter
• Argument1Type : CDPL::Math::Scalar13QuaternionTernaryFunctor< T1, Q, T2 > , CDPL::Math::Scalar1QuaternionAddition< T, Q > , CDPL::Math::Scalar1QuaternionBinaryFunctor< T, Q > , CDPL::Math::Scalar1QuaternionSubtraction< T, Q > , CDPL::Math::ScalarAddition< T1, T2 > , CDPL::Math::ScalarAdditionAssignment< T1, T2 > , CDPL::Math::ScalarAssignment< T1, T2 > , CDPL::Math::ScalarBinaryAssignmentFunctor< T1, T2 > , CDPL::Math::ScalarBinaryFunctor< T1, T2 > , CDPL::Math::ScalarDivision< T1, T2 > , CDPL::Math::ScalarDivisionAssignment< T1, T2 > , CDPL::Math::ScalarMultiplication< T1, T2 > , CDPL::Math::ScalarMultiplicationAssignment< T1, T2 > , CDPL::Math::ScalarQuaternionDivision< T1, Q, T2 > , CDPL::Math::ScalarSubtraction< T1, T2 > , CDPL::Math::ScalarSubtractionAssignment< T1, T2 >
• Argument2Type : CDPL::Math::QuaternionInverse< Q, T > , CDPL::Math::Scalar2QuaternionAddition< Q, T > , CDPL::Math::Scalar2QuaternionBinaryFunctor< Q, T > , CDPL::Math::Scalar2QuaternionSubtraction< Q, T > , CDPL::Math::ScalarAddition< T1, T2 > , CDPL::Math::ScalarAdditionAssignment< T1, T2 > , CDPL::Math::ScalarAssignment< T1, T2 > , CDPL::Math::ScalarBinaryAssignmentFunctor< T1, T2 > , CDPL::Math::ScalarBinaryFunctor< T1, T2 > , CDPL::Math::ScalarDivision< T1, T2 > , CDPL::Math::ScalarDivisionAssignment< T1, T2 > , CDPL::Math::ScalarMultiplication< T1, T2 > , CDPL::Math::ScalarMultiplicationAssignment< T1, T2 > , CDPL::Math::ScalarSubtraction< T1, T2 > , CDPL::Math::ScalarSubtractionAssignment< T1, T2 >
• Argument3Type : CDPL::Math::GridToleranceEquality< G1, G2, T > , CDPL::Math::MatrixToleranceEquality< M1, M2, T > , CDPL::Math::QuaternionDivision< Q1, Q2, T > , CDPL::Math::QuaternionToleranceEquality< Q1, Q2, T > , CDPL::Math::Scalar13QuaternionTernaryFunctor< T1, Q, T2 > , CDPL::Math::Scalar3GridBooleanTernaryFunctor< G1, G2, T > , CDPL::Math::Scalar3MatrixBooleanTernaryFunctor< M1, M2, T > , CDPL::Math::Scalar3QuaternionBooleanTernaryFunctor< Q1, Q2, T > , CDPL::Math::Scalar3QuaternionTernaryFunctor< Q1, Q2, T > , CDPL::Math::Scalar3VectorBooleanTernaryFunctor< V1, V2, T > , CDPL::Math::ScalarQuaternionDivision< T1, Q, T2 > , CDPL::Math::VectorToleranceEquality< V1, V2, T >
• ArgumentType : CDPL::Math::ScalarConjugation< T > , CDPL::Math::ScalarImaginary< T > , CDPL::Math::ScalarNegation< T > , CDPL::Math::ScalarReal< T > , CDPL::Math::ScalarRealUnaryFunctor< T > , CDPL::Math::ScalarUnaryFunctor< T >
• AromaticFeatureGenerator() : CDPL::Pharm::AromaticFeatureGenerator
• AromaticRingSet() : CDPL::Chem::AromaticRingSet
• AromaticSSSRSubset() : CDPL::Chem::AromaticSSSRSubset
• AromaticSubstructure() : CDPL::Chem::AromaticSubstructure
• Array() : CDPL::Util::Array< ValueType >
• ArrayPointer : CDPL::Math::BoundedMatrix< T, M, N > , CDPL::Math::CMatrix< T, M, N >
• ArrayType : CDPL::Math::BoundedMatrix< T, M, N > , CDPL::Math::BoundedVector< T, N > , CDPL::Math::CMatrix< T, M, N > , CDPL::Math::CVector< T, N > , CDPL::Math::Grid< T, A > , CDPL::Math::Matrix< T, A > , CDPL::Math::MinimizerVariableArrayTraits< A > , CDPL::Math::MinimizerVariableArrayTraits< std::vector< V > > , CDPL::Math::MinimizerVariableArrayTraits< VectorArray< V > > , CDPL::Math::Quaternion< T > , CDPL::Math::SparseContainerElement< C, K > , CDPL::Math::SparseMatrix< T, A > , CDPL::Math::SparseVector< T, A > , CDPL::Math::Vector< T, A >
• assemble() : CDPL::ConfGen::FragmentAssembler
• assign() : CDPL::Math::BoundedMatrix< T, M, N > , CDPL::Math::BoundedVector< T, N > , CDPL::Math::CMatrix< T, M, N > , CDPL::Math::CVector< T, N > , CDPL::Math::Grid< T, A > , CDPL::Math::GridReference< G > , CDPL::Math::HomogenousCoordsAdapter< V > , CDPL::Math::Matrix< T, A > , CDPL::Math::MatrixColumn< M > , CDPL::Math::MatrixRange< M > , CDPL::Math::MatrixReference< M > , CDPL::Math::MatrixRow< M > , CDPL::Math::MatrixSlice< M > , CDPL::Math::MatrixTranspose< M > , CDPL::Math::MinimizerVariableArrayTraits< A > , CDPL::Math::MinimizerVariableArrayTraits< std::vector< V > > , CDPL::Math::MinimizerVariableArrayTraits< VectorArray< V > > , CDPL::Math::Quaternion< T > , CDPL::Math::QuaternionReference< Q > , CDPL::Math::QuaternionVectorAdapter< Q > , CDPL::Math::RealQuaternion< T > , CDPL::Math::RegularSpatialGrid< T, C, GD, XF > , CDPL::Math::SparseMatrix< T, A > , CDPL::Math::SparseVector< T, A > , CDPL::Math::Vector< T, A > , CDPL::Math::VectorQuaternionAdapter< V > , CDPL::Math::VectorRange< V > , CDPL::Math::VectorReference< V > , CDPL::Math::VectorSlice< V > , CDPL::Util::Array< ValueType >
• atom1ID : CDPL::Chem::PatternBasedTautomerizationRule::BondOrderChange
• Atom2DCoordinatesCalculator() : CDPL::Chem::Atom2DCoordinatesCalculator
• Atom2DCoordinatesFunction : CDPL::Chem::BondStereoFlagCalculator
• atom2ID : CDPL::Chem::PatternBasedTautomerizationRule::BondOrderChange
• Atom3DCoordinatesFunction : CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator , CDPL::Descr::MoleculeRDFDescriptorCalculator
• ATOM_CENTERS : CDPL::Shape::ScreeningSettings
• AtomArray3DCoordinatesFunctor() : CDPL::Chem::AtomArray3DCoordinatesFunctor
• AtomAutoCorrelation3DVectorCalculator() : CDPL::Descr::AtomAutoCorrelation3DVectorCalculator
• atomConfigEnumerated() : CDPL::Chem::StereoisomerGenerator
• AtomConfigurationMatchExpression() : CDPL::Chem::AtomConfigurationMatchExpression
• AtomConformer3DCoordinatesFunctor() : CDPL::Chem::AtomConformer3DCoordinatesFunctor
• AtomDensityGridCalculator() : CDPL::GRAIL::AtomDensityGridCalculator
• AtomDescriptorFunction : CDPL::Descr::PathFingerprintGenerator
• AtomEnvironmentMatchExpression() : CDPL::Chem::AtomEnvironmentMatchExpression
• AtomHashSeedFunction : CDPL::Chem::HashCodeCalculator
• AtomHydrophobicityCalculator() : CDPL::MolProp::AtomHydrophobicityCalculator
• AtomIdentifierFunction : CDPL::Descr::CircularFingerprintGenerator
• AtomIterator : CDPL::Chem::Atom , CDPL::Chem::AtomContainer , CDPL::Chem::BasicAtom , CDPL::Chem::BasicMolecule , CDPL::Chem::Bond , CDPL::Chem::ElectronSystem , CDPL::Chem::Fragment , CDPL::Chem::Molecule , CDPL::ConfGen::CanonicalFragment
• AtomList : CDPL::Pharm::PatternBasedFeatureGenerator
• AtomMapping : CDPL::ConfGen::CanonicalFragment
• AtomMatchExpressionFunction : CDPL::Chem::SubstructureSearch
• AtomPairWeightFunction : CDPL::Descr::AutoCorrelation2DVectorCalculator , CDPL::Descr::MoleculeAutoCorr2DDescriptorCalculator , CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator , CDPL::Descr::MoleculeRDFDescriptorCalculator
• AtomRDFCodeCalculator() : CDPL::Descr::AtomRDFCodeCalculator
• AtomSSSRRingSizeMatchExpression() : CDPL::Chem::AtomSSSRRingSizeMatchExpression< MatchFunc >
• AtomTypeMatchExpression() : CDPL::Chem::AtomTypeMatchExpression
• AtomWeightFunction : CDPL::Descr::BCUTDescriptorCalculator , CDPL::Descr::BurdenMatrixGenerator
• AUTHOR : CDPL::Biomol::PDBData
• AutoCorrelation2DVectorCalculator() : CDPL::Descr::AutoCorrelation2DVectorCalculator
• AutoCorrelation3DVectorCalculator() : CDPL::Descr::AutoCorrelation3DVectorCalculator< T >
• AutomorphismGroupSearch() : CDPL::Chem::AutomorphismGroupSearch
• axpy() : CDPL::Math::MinimizerVariableArrayTraits< A > , CDPL::Math::MinimizerVariableArrayTraits< std::vector< V > > , CDPL::Math::MinimizerVariableArrayTraits< VectorArray< V > >