Here is a list of all class members with links to the classes they belong to:
- c -
- CairoFontMetrics()
: CDPL::Vis::CairoFontMetrics
- CairoPointer()
: CDPL::Vis::CairoPointer< T >
- CairoRenderer2D()
: CDPL::Vis::CairoRenderer2D
- calcAtomDensityGrid()
: CDPL::GRAIL::GRAILDataSetGenerator
- calcCentroid()
: CDPL::Pharm::PatternBasedFeatureGenerator
, CDPL::Shape::GaussianShapeFunction
- calcColorOverlap()
: CDPL::Shape::ExactGaussianShapeOverlapFunction
, CDPL::Shape::FastGaussianShapeOverlapFunction
, CDPL::Shape::GaussianShapeOverlapFunction
- calcColorOverlaps()
: CDPL::Shape::GaussianShapeAlignment
, CDPL::Shape::GaussianShapeFunctionAlignment
- calcColorSelfOverlap()
: CDPL::Shape::ExactGaussianShapeOverlapFunction
, CDPL::Shape::FastGaussianShapeOverlapFunction
, CDPL::Shape::GaussianShapeFunctionAlignment
, CDPL::Shape::GaussianShapeOverlapFunction
- calcColorSelfOverlaps()
: CDPL::Shape::GaussianShapeAlignment
- calcDensity()
: CDPL::Shape::GaussianShapeFunction
- calcInteractionGrids()
: CDPL::GRAIL::GRAILDataSetGenerator
- calcOverlap()
: CDPL::Shape::ExactGaussianShapeOverlapFunction
, CDPL::Shape::FastGaussianShapeOverlapFunction
, CDPL::Shape::GaussianShapeOverlapFunction
- calcOverlapGradient()
: CDPL::Shape::ExactGaussianShapeOverlapFunction
, CDPL::Shape::FastGaussianShapeOverlapFunction
, CDPL::Shape::GaussianShapeOverlapFunction
- calcPlaneFeatureOrientation()
: CDPL::Pharm::PatternBasedFeatureGenerator
- calcQuadrupoleTensor()
: CDPL::Shape::GaussianShapeFunction
- calcSelfOverlap()
: CDPL::Shape::ExactGaussianShapeOverlapFunction
, CDPL::Shape::FastGaussianShapeOverlapFunction
, CDPL::Shape::GaussianShapeFunctionAlignment
, CDPL::Shape::GaussianShapeOverlapFunction
- calcSelfOverlaps()
: CDPL::Shape::GaussianShapeAlignment
- calcStatistics()
: CDPL::Math::MLRModel< T >
- calcSurfaceArea()
: CDPL::Shape::GaussianShapeFunction
- calculate()
: CDPL::Chem::Atom2DCoordinatesCalculator
, CDPL::Chem::BondOrderCalculator
, CDPL::Chem::BondStereoFlagCalculator
, CDPL::Chem::CanonicalNumberingCalculator
, CDPL::Chem::CIPPriorityCalculator
, CDPL::Chem::HashCodeCalculator
, CDPL::Chem::Hydrogen3DCoordinatesCalculator
, CDPL::Chem::KekuleStructureCalculator
, CDPL::Chem::MorganNumberingCalculator
, CDPL::Chem::SubstructureHistogramCalculator
, CDPL::Chem::SymmetryClassCalculator
, CDPL::Descr::AtomAutoCorrelation3DVectorCalculator
, CDPL::Descr::AtomRDFCodeCalculator
, CDPL::Descr::AutoCorrelation2DVectorCalculator
, CDPL::Descr::AutoCorrelation3DVectorCalculator< T >
, CDPL::Descr::BCUTDescriptorCalculator
, CDPL::Descr::FeatureAutoCorrelation3DVectorCalculator
, CDPL::Descr::FeatureRDFCodeCalculator
, CDPL::Descr::MolecularComplexityCalculator
, CDPL::Descr::MoleculeAutoCorr2DDescriptorCalculator
, CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
, CDPL::Descr::MoleculeRDFDescriptorCalculator
, CDPL::Descr::PharmacophoreAutoCorr3DDescriptorCalculator
, CDPL::Descr::PharmacophoreRDFDescriptorCalculator
, CDPL::Descr::RDFCodeCalculator< T >
, CDPL::ForceField::MMFF94ChargeCalculator
, CDPL::GRAIL::AtomDensityGridCalculator
, CDPL::GRAIL::BuriednessGridCalculator
, CDPL::GRAIL::FeatureInteractionScoreGridCalculator
, CDPL::GRAIL::GRAILDescriptorCalculator
, CDPL::GRAIL::GRAILXDescriptorCalculator
, CDPL::Math::VectorArrayAlignmentCalculator< VA, V, T >
, CDPL::MolProp::AtomHydrophobicityCalculator
, CDPL::MolProp::LogSCalculator
, CDPL::MolProp::MHMOPiChargeCalculator
, CDPL::MolProp::PEOESigmaChargeCalculator
, CDPL::MolProp::TPSACalculator
, CDPL::MolProp::XLogPCalculator
- CalculationFailed()
: CDPL::Base::CalculationFailed
- calcVecFeatureOrientation()
: CDPL::Pharm::PatternBasedFeatureGenerator
- calcVolume()
: CDPL::Shape::GaussianShapeFunction
- calcYValue()
: CDPL::Math::MLRModel< T >
- CallbackFunction
: CDPL::Chem::TautomerGenerator
- CanonicalFragment()
: CDPL::ConfGen::CanonicalFragment
- CanonicalNumberingCalculator()
: CDPL::Chem::CanonicalNumberingCalculator
- CapStyle
: CDPL::Vis::Pen
- carbonBond12ChargesMinimized()
: CDPL::Chem::ResonanceStructureGenerator
- CategoryIterator
: CDPL::ConfGen::TorsionCategory
- CationPiInteractionConstraint()
: CDPL::Pharm::CationPiInteractionConstraint
- CationPiInteractionScore()
: CDPL::Pharm::CationPiInteractionScore
- CAVEAT
: CDPL::Biomol::PDBData
- CDFDRegularGridReader()
: CDPL::Grid::CDFDRegularGridReader
- CDFDRegularGridSetReader()
: CDPL::Grid::CDFDRegularGridSetReader
- CDFDRegularGridSetWriter()
: CDPL::Grid::CDFDRegularGridSetWriter
- CDFDRegularGridWriter()
: CDPL::Grid::CDFDRegularGridWriter
- CDFFeatureContainerWriter()
: CDPL::Pharm::CDFFeatureContainerWriter
- CDFMolecularGraphWriter()
: CDPL::Chem::CDFMolecularGraphWriter
- CDFMoleculeReader()
: CDPL::Chem::CDFMoleculeReader
- CDFPharmacophoreReader()
: CDPL::Pharm::CDFPharmacophoreReader
- CDFReactionReader()
: CDPL::Chem::CDFReactionReader
- CDFReactionWriter()
: CDPL::Chem::CDFReactionWriter
- CELL
: CDPL::Math::RegularSpatialGrid< T, C, GD, XF >
- center
: CDPL::Shape::FastGaussianShapeAlignment::ShapeData::Element
- CFLMoleculeReader()
: CDPL::ConfGen::CFLMoleculeReader
- ChangeFlags
: CDPL::Chem::ChEMBLStandardizer
- char_type
: CDPL::Util::CompressedIOStream< CompAlgo, CharT, TraitsT >
, CDPL::Util::CompressionOStream< CompAlgo, CharT, TraitsT >
, CDPL::Util::CompressionStreamBase< CompAlgo, StreamType >
, CDPL::Util::DecompressionIStream< CompAlgo, CharT, TraitsT >
- CHARGES_REMOVED
: CDPL::Chem::ChEMBLStandardizer
- checkAtomConfigurations()
: CDPL::ConfGen::DGStructureGenerator
- checkBondConfigurations()
: CDPL::ConfGen::DGStructureGenerator
- checkIfNonEmpty()
: CDPL::Util::Array< ValueType >
- checkIndex()
: CDPL::Util::Array< ValueType >
- checkIterator()
: CDPL::Util::Array< ValueType >
- checkXVolumeClashes()
: CDPL::Pharm::ScreeningProcessor
- ChEMBLStandardizer()
: CDPL::Chem::ChEMBLStandardizer
, CDPL::Chem::ProtonationStateStandardizer
- chiralityIncluded()
: CDPL::Descr::CircularFingerprintGenerator
- CIPConfigurationLabeler()
: CDPL::Chem::CIPConfigurationLabeler
- CIPPriorityCalculator()
: CDPL::Chem::CIPPriorityCalculator
- CircularFingerprintGenerator()
: CDPL::Descr::CircularFingerprintGenerator
- CISPEP
: CDPL::Biomol::PDBData
- clear()
: CDPL::Base::Any
, CDPL::Biomol::PDBData
, CDPL::Biomol::ResidueDictionary
, CDPL::Chem::AtomBondMapping
, CDPL::Chem::AtomDictionary
, CDPL::Chem::BasicMolecule
, CDPL::Chem::BasicReaction
, CDPL::Chem::ElectronSystem
, CDPL::Chem::Fragment
, CDPL::Chem::Molecule
, CDPL::Chem::PatternAtomTyper
, CDPL::Chem::Reaction
, CDPL::Chem::SubstructureHistogramCalculator
, CDPL::ConfGen::CanonicalFragment
, CDPL::ConfGen::FragmentLibrary
, CDPL::ConfGen::TorsionCategory
, CDPL::ConfGen::TorsionRule
, CDPL::ForceField::GradientVectorTraits< GV >
, CDPL::ForceField::GradientVectorTraits< Math::VectorArray< V > >
, CDPL::ForceField::GradientVectorTraits< std::vector< V > >
, 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::MMFF94InteractionData
, 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
, 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::RegularSpatialGrid< T, C, GD, XF >
, CDPL::Math::SparseMatrix< T, A >
, CDPL::Math::SparseVector< T, A >
, CDPL::Math::Vector< T, A >
, CDPL::Pharm::BasicPharmacophore
, CDPL::Pharm::FeatureSet
, CDPL::Pharm::Pharmacophore
, CDPL::Shape::GaussianShape
, CDPL::Util::Array< ValueType >
, CDPL::Util::CompoundDataReader< DataType >
, CDPL::Util::Map< Key, Value, AllowDefValues, KeyCompFunc >
, CDPL::Util::MultiMap< Key, Value, AllowDefValues, KeyCompFunc >
, CDPL::Vis::Path2D
- clearAtomMappingConstraints()
: CDPL::Chem::AutomorphismGroupSearch
, CDPL::Chem::SubstructureSearch
- clearBondMappingConstraints()
: CDPL::Chem::AutomorphismGroupSearch
, CDPL::Chem::SubstructureSearch
- clearClipPath()
: CDPL::Vis::CairoRenderer2D
, CDPL::Vis::QtRenderer2D
, CDPL::Vis::Renderer2D
- clearConformers()
: CDPL::ConfGen::FragmentLibraryEntry
- clearDataSet()
: CDPL::Math::MLRModel< T >
- clearDistanceConstraints()
: CDPL::Util::DGCoordinatesGeneratorBase< Dim, T, Derived >
- clearEnabledFeatures()
: CDPL::Pharm::PharmacophoreGenerator
- clearEnabledInteractions()
: CDPL::GRAIL::GRAILDataSetGenerator
- clearEnergyWindowRanges()
: CDPL::ConfGen::ConformerGeneratorSettings
- clearEntities()
: CDPL::Chem::SpatialEntityAlignment< T >
, CDPL::Chem::TopologicalEntityAlignment< T >
- clearExcludePatterns()
: CDPL::Chem::FragmentGenerator
, CDPL::Chem::PatternBasedTautomerizationRule
, CDPL::Pharm::PatternBasedFeatureGenerator
- clearFileExtensions()
: CDPL::Base::DataFormat
- clearFilterFunctions()
: CDPL::ForceField::MMFF94InteractionParameterizer
- clearFragmentationRules()
: CDPL::Chem::FragmentGenerator
- clearFragmentLibraries()
: CDPL::ConfGen::ConformerGenerator
, CDPL::ConfGen::FragmentAssembler
, CDPL::ConfGen::StructureGenerator
- clearIncludePatterns()
: CDPL::Pharm::PatternBasedFeatureGenerator
- clearInputCoordinates()
: CDPL::ConfGen::TorsionDriver
- clearIOCallbacks()
: CDPL::Base::DataIOBase
- clearMaxNumOutputConformersRanges()
: CDPL::ConfGen::ConformerGeneratorSettings
- clearMinRMSDRanges()
: CDPL::ConfGen::ConformerGeneratorSettings
- clearParameters()
: CDPL::Base::ControlParameterContainer
- clearProperties()
: CDPL::Base::PropertyContainer
- clearQuerySet()
: CDPL::Shape::ScreeningProcessor
- clearReferenceShapes()
: CDPL::Shape::FastGaussianShapeAlignment
, CDPL::Shape::GaussianShapeAlignment
- clearTorsionLibraries()
: CDPL::ConfGen::ConformerGenerator
, CDPL::ConfGen::StructureGenerator
, CDPL::ConfGen::TorsionDriver
- clearVolumeConstraints()
: CDPL::Util::DGCoordinatesGenerator< 3, T >
- clipBeginAgainstLineSeg()
: CDPL::Vis::Line2D
- clipBeginAgainstRectangle()
: CDPL::Vis::Line2D
- clipEndAgainstLineSeg()
: CDPL::Vis::Line2D
- clipEndAgainstRectangle()
: CDPL::Vis::Line2D
- ClipPathPrimitive2D()
: CDPL::Vis::ClipPathPrimitive2D
- clone()
: CDPL::Chem::BasicMolecule
, CDPL::Chem::BasicReaction
, CDPL::Chem::Fragment
, CDPL::Chem::MolecularGraph
, CDPL::Chem::PatternBasedTautomerizationRule
, CDPL::Chem::Reaction
, CDPL::Chem::TautomerizationRule
, CDPL::ConfGen::CanonicalFragment
, CDPL::Pharm::AromaticFeatureGenerator
, CDPL::Pharm::BasicPharmacophore
, CDPL::Pharm::FeatureGenerator
, CDPL::Pharm::HydrophobicAtomFeatureGenerator
, CDPL::Pharm::HydrophobicFeatureGenerator
, CDPL::Pharm::PatternBasedFeatureGenerator
, CDPL::Pharm::Pharmacophore
, CDPL::Pharm::PharmacophoreGenerator
, CDPL::Vis::ClipPathPrimitive2D
, CDPL::Vis::EllipsePrimitive2D
, CDPL::Vis::GraphicsPrimitive2D
, CDPL::Vis::LinePrimitive2D
, CDPL::Vis::LineSegmentListPrimitive2D
, CDPL::Vis::PathPrimitive2D
, CDPL::Vis::PointListPrimitive2D
, CDPL::Vis::PolygonPrimitive2D
, CDPL::Vis::PolylinePrimitive2D
, CDPL::Vis::TextLabelPrimitive2D
- close()
: CDPL::Base::DataReader< T >
, CDPL::Base::DataWriter< T >
, CDPL::Pharm::PMLFeatureContainerWriter
, CDPL::Pharm::PSDMolecularGraphWriter
, CDPL::Pharm::PSDScreeningDBAccessor
, CDPL::Pharm::PSDScreeningDBCreator
, CDPL::Pharm::ScreeningDBAccessor
, CDPL::Pharm::ScreeningDBCreator
, CDPL::Util::CompressedDataReader< ReaderImpl, DecompStream, DataType >
, CDPL::Util::CompressedDataWriter< WriterImpl, CompStream, DataType >
, CDPL::Util::CompressedIOStream< CompAlgo, CharT, TraitsT >
, CDPL::Util::CompressionOStream< CompAlgo, CharT, TraitsT >
, CDPL::Util::DecompressionIStream< CompAlgo, CharT, TraitsT >
, CDPL::Util::FileDataReader< ReaderImpl, DataType >
, CDPL::Util::FileDataWriter< WriterImpl, DataType >
, CDPL::Util::MultiFormatDataReader< DataType >
, CDPL::Util::MultiFormatDataWriter< DataType >
- closePath()
: CDPL::Vis::Path2D
, CDPL::Vis::Path2DConverter
- closeTmpFile()
: CDPL::Util::CompressionStreamBase< CompAlgo, StreamType >
- ClosureType
: 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::GridBinary1< E1, E2, F >
, CDPL::Math::GridReference< G >
, CDPL::Math::GridUnary< E, F >
, CDPL::Math::HomogenousCoordsAdapter< V >
, CDPL::Math::IdentityMatrix< T >
, CDPL::Math::InitListMatrix< T >
, CDPL::Math::InitListVector< T >
, CDPL::Math::Matrix1VectorBinary< E1, E2, F >
, CDPL::Math::Matrix2VectorBinary< E1, E2, F >
, CDPL::Math::Matrix< T, A >
, CDPL::Math::MatrixBinary1< E1, E2, F >
, CDPL::Math::MatrixBinary2< E1, E2, F >
, 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::MatrixUnary< E, F >
, CDPL::Math::Quaternion< T >
, CDPL::Math::QuaternionBinary1< E1, E2, F >
, CDPL::Math::QuaternionBinary2< E1, E2, F >
, CDPL::Math::QuaternionReference< Q >
, CDPL::Math::QuaternionUnary1< E, F >
, CDPL::Math::QuaternionUnary2< E, F >
, CDPL::Math::QuaternionVectorAdapter< Q >
, CDPL::Math::QuaternionVectorBinary< E1, E2, F >
, CDPL::Math::RealQuaternion< T >
, CDPL::Math::RegularSpatialGrid< T, C, GD, XF >
, CDPL::Math::RotationMatrix< T >
, CDPL::Math::Scalar13QuaternionTernary< E1, E2, E3, F >
, CDPL::Math::Scalar1GridBinary< E1, E2, F >
, CDPL::Math::Scalar1MatrixBinary< E1, E2, F >
, CDPL::Math::Scalar1QuaternionBinary1< E1, E2, F >
, CDPL::Math::Scalar1QuaternionBinary2< E1, E2, F >
, CDPL::Math::Scalar1VectorBinary< E1, E2, F >
, CDPL::Math::Scalar2GridBinary< E1, E2, F >
, CDPL::Math::Scalar2MatrixBinary< E1, E2, F >
, CDPL::Math::Scalar2QuaternionBinary1< E1, E2, F >
, CDPL::Math::Scalar2QuaternionBinary2< E1, E2, F >
, CDPL::Math::Scalar2VectorBinary< E1, E2, F >
, CDPL::Math::Scalar3QuaternionTernary< E1, E2, E3, F >
, CDPL::Math::ScalarGrid< T >
, CDPL::Math::ScalarMatrix< T >
, CDPL::Math::ScalarVector< T >
, CDPL::Math::ScalingMatrix< T >
, CDPL::Math::SparseMatrix< T, A >
, CDPL::Math::SparseVector< T, A >
, CDPL::Math::TranslationMatrix< T >
, CDPL::Math::TriangularAdapter< M, Tri >
, CDPL::Math::UnitVector< T >
, CDPL::Math::Vector< T, A >
, CDPL::Math::VectorBinary1< E1, E2, F >
, CDPL::Math::VectorBinary2< E1, E2, F >
, CDPL::Math::VectorMatrixBinary< E1, E2, F >
, CDPL::Math::VectorMatrixUnary< E, F >
, CDPL::Math::VectorQuaternionAdapter< V >
, CDPL::Math::VectorRange< V >
, CDPL::Math::VectorReference< V >
, CDPL::Math::VectorSlice< V >
, CDPL::Math::VectorUnary< E, F >
, CDPL::Math::ZeroGrid< T >
, CDPL::Math::ZeroMatrix< T >
, CDPL::Math::ZeroVector< T >
- CMatrix()
: CDPL::Math::CMatrix< T, M, N >
- color
: CDPL::Shape::FastGaussianShapeAlignment::ShapeData::Element
- Color()
: CDPL::Vis::Color
- COLOR_FEATURE_CENTERS
: CDPL::Shape::ScreeningSettings
- ColorFeatureType
: CDPL::Shape::ScreeningSettings
- ColorFilterFunction
: CDPL::Shape::GaussianShapeAlignment
, CDPL::Shape::GaussianShapeFunctionAlignment
, CDPL::Shape::GaussianShapeOverlapFunction
- ColorMatchFunction
: CDPL::Shape::GaussianShapeAlignment
, CDPL::Shape::GaussianShapeFunctionAlignment
, CDPL::Shape::GaussianShapeOverlapFunction
- ColorTable()
: CDPL::Vis::ColorTable
- ColorTverskyScore()
: CDPL::Shape::ColorTverskyScore
- CombinationFunction
: CDPL::Pharm::FeatureInteractionScoreCombiner
- CommonConnectedSubstructureSearch()
: CDPL::Chem::CommonConnectedSubstructureSearch
- CompFilter
: CDPL::Util::CompressionAlgoTraits< BZIP2 >
, CDPL::Util::CompressionAlgoTraits< GZIP >
- CompleteRingSet()
: CDPL::Chem::CompleteRingSet
- COMPND
: CDPL::Biomol::PDBData
- ComponentIterator
: CDPL::Chem::BasicReaction
, CDPL::Chem::Reaction
- ComponentSet()
: CDPL::Chem::ComponentSet
- CompoundDataReader()
: CDPL::Util::CompoundDataReader< DataType >
- compOutput()
: CDPL::Util::CompressionStreamBase< CompAlgo, StreamType >
- CompressedDataReader()
: CDPL::Util::CompressedDataReader< ReaderImpl, DecompStream, DataType >
- CompressedDataWriter()
: CDPL::Util::CompressedDataWriter< WriterImpl, CompStream, DataType >
- CompressedIOStream()
: CDPL::Util::CompressedIOStream< CompAlgo, CharT, TraitsT >
- CompressionOStream()
: CDPL::Util::CompressionOStream< CompAlgo, CharT, TraitsT >
- CompressionStreamBase()
: CDPL::Util::CompressionStreamBase< CompAlgo, StreamType >
- Configuration
: CDPL::Pharm::DefaultPharmacophoreGenerator
- ConformerData()
: CDPL::ConfGen::ConformerData
- ConformerGenerator()
: CDPL::ConfGen::ConformerGenerator
- ConformerGeneratorSettings()
: CDPL::ConfGen::ConformerGeneratorSettings
- ConformerIterator
: CDPL::ConfGen::ConformerGenerator
, CDPL::ConfGen::FragmentAssembler
, CDPL::ConfGen::FragmentConformerGenerator
, CDPL::ConfGen::FragmentLibraryEntry
, CDPL::ConfGen::TorsionDriver
- conj()
: CDPL::Math::ComplexTraits< T >
, CDPL::Math::ScalarTraits< T >
- connected()
: CDPL::Chem::ElectronSystem
- ConnectedSubstructureSet()
: CDPL::Chem::ConnectedSubstructureSet
- ConstAngleEntryIterator
: CDPL::ConfGen::TorsionRule
- ConstArrayPointer
: CDPL::Math::BoundedMatrix< T, M, N >
, CDPL::Math::CMatrix< T, M, N >
- ConstAtomIterator
: 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
- ConstBondIterator
: CDPL::Chem::Atom
, CDPL::Chem::BasicAtom
, CDPL::Chem::BasicMolecule
, CDPL::Chem::BondContainer
, CDPL::Chem::Fragment
, CDPL::Chem::Molecule
, CDPL::ConfGen::CanonicalFragment
- ConstCategoryIterator
: CDPL::ConfGen::TorsionCategory
- ConstChainIterator
: CDPL::Biomol::HierarchyViewModel
- ConstClosureType
: 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::GridBinary1< E1, E2, F >
, CDPL::Math::GridReference< G >
, CDPL::Math::GridUnary< E, F >
, CDPL::Math::HomogenousCoordsAdapter< V >
, CDPL::Math::IdentityMatrix< T >
, CDPL::Math::InitListMatrix< T >
, CDPL::Math::InitListVector< T >
, CDPL::Math::Matrix1VectorBinary< E1, E2, F >
, CDPL::Math::Matrix2VectorBinary< E1, E2, F >
, CDPL::Math::Matrix< T, A >
, CDPL::Math::MatrixBinary1< E1, E2, F >
, CDPL::Math::MatrixBinary2< E1, E2, F >
, 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::MatrixUnary< E, F >
, CDPL::Math::Quaternion< T >
, CDPL::Math::QuaternionBinary1< E1, E2, F >
, CDPL::Math::QuaternionBinary2< E1, E2, F >
, CDPL::Math::QuaternionReference< Q >
, CDPL::Math::QuaternionUnary1< E, F >
, CDPL::Math::QuaternionUnary2< E, F >
, CDPL::Math::QuaternionVectorAdapter< Q >
, CDPL::Math::QuaternionVectorBinary< E1, E2, F >
, CDPL::Math::RealQuaternion< T >
, CDPL::Math::RegularSpatialGrid< T, C, GD, XF >
, CDPL::Math::RotationMatrix< T >
, CDPL::Math::Scalar13QuaternionTernary< E1, E2, E3, F >
, CDPL::Math::Scalar1GridBinary< E1, E2, F >
, CDPL::Math::Scalar1MatrixBinary< E1, E2, F >
, CDPL::Math::Scalar1QuaternionBinary1< E1, E2, F >
, CDPL::Math::Scalar1QuaternionBinary2< E1, E2, F >
, CDPL::Math::Scalar1VectorBinary< E1, E2, F >
, CDPL::Math::Scalar2GridBinary< E1, E2, F >
, CDPL::Math::Scalar2MatrixBinary< E1, E2, F >
, CDPL::Math::Scalar2QuaternionBinary1< E1, E2, F >
, CDPL::Math::Scalar2QuaternionBinary2< E1, E2, F >
, CDPL::Math::Scalar2VectorBinary< E1, E2, F >
, CDPL::Math::Scalar3QuaternionTernary< E1, E2, E3, F >
, CDPL::Math::ScalarGrid< T >
, CDPL::Math::ScalarMatrix< T >
, CDPL::Math::ScalarVector< T >
, CDPL::Math::ScalingMatrix< T >
, CDPL::Math::SparseMatrix< T, A >
, CDPL::Math::SparseVector< T, A >
, CDPL::Math::TranslationMatrix< T >
, CDPL::Math::TriangularAdapter< M, Tri >
, CDPL::Math::UnitVector< T >
, CDPL::Math::Vector< T, A >
, CDPL::Math::VectorBinary1< E1, E2, F >
, CDPL::Math::VectorBinary2< E1, E2, F >
, CDPL::Math::VectorMatrixBinary< E1, E2, F >
, CDPL::Math::VectorMatrixUnary< E, F >
, CDPL::Math::VectorQuaternionAdapter< V >
, CDPL::Math::VectorRange< V >
, CDPL::Math::VectorReference< V >
, CDPL::Math::VectorSlice< V >
, CDPL::Math::VectorUnary< E, F >
, CDPL::Math::ZeroGrid< T >
, CDPL::Math::ZeroMatrix< T >
, CDPL::Math::ZeroVector< T >
- ConstComponentIterator
: CDPL::Chem::BasicReaction
, CDPL::Chem::Reaction
- ConstConformerIterator
: CDPL::ConfGen::ConformerGenerator
, CDPL::ConfGen::FragmentAssembler
, CDPL::ConfGen::FragmentConformerGenerator
, CDPL::ConfGen::FragmentLibraryEntry
, CDPL::ConfGen::TorsionDriver
- ConstDistanceConstraintIterator
: CDPL::Util::DGCoordinatesGeneratorBase< Dim, T, Derived >
- ConstElementIterator
: CDPL::Shape::GaussianShape
, CDPL::Util::Array< ValueType >
, CDPL::Util::IndirectArray< ValueType, PointerType, NullPointerCheck >
- ConstEntityIterator
: CDPL::Chem::Entity3DContainer
, CDPL::Chem::SpatialEntityAlignment< T >
, CDPL::Chem::TopologicalEntityAlignment< T >
- ConstEntryIterator
: CDPL::Biomol::ResidueDictionary
, CDPL::Chem::AtomDictionary
, 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
, CDPL::Util::Map< Key, Value, AllowDefValues, KeyCompFunc >
, CDPL::Util::MultiMap< Key, Value, AllowDefValues, KeyCompFunc >
- ConstEntryIteratorRange
: CDPL::Util::MultiMap< Key, Value, AllowDefValues, KeyCompFunc >
- ConstExcludePatternIterator
: CDPL::Chem::FragmentGenerator
- ConstFeatureIterator
: CDPL::Pharm::BasicPharmacophore
, CDPL::Pharm::FeatureContainer
, CDPL::Pharm::FeatureSet
, CDPL::Pharm::Pharmacophore
- ConstFileExtensionIterator
: CDPL::Base::DataFormat
- ConstFragmentationRuleIterator
: CDPL::Chem::FragmentGenerator
- ConstFragmentIterator
: CDPL::Biomol::HierarchyViewChain
- ConstFragmentLinkIterator
: CDPL::Chem::FragmentGenerator
- ConstMappingIterator
: CDPL::Chem::AutomorphismGroupSearch
, CDPL::Chem::CommonConnectedSubstructureSearch
, CDPL::Chem::MaxCommonAtomSubstructureSearch
, CDPL::Chem::MaxCommonBondSubstructureSearch
, CDPL::Chem::ReactionSubstructureSearch
, CDPL::Chem::SubstructureSearch
- ConstMatchIterator
: CDPL::ConfGen::TorsionRuleMatcher
- ConstModelIterator
: CDPL::Biomol::HierarchyView
- ConstMolecularGraphIterator
: CDPL::Shape::ScreeningProcessor
- ConstParameterIterator
: CDPL::Base::ControlParameterContainer
- ConstPatternIterator
: CDPL::Chem::PatternAtomTyper
, CDPL::Chem::SubstructureHistogramCalculator
- ConstPointer
: 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::Quaternion< T >
, CDPL::Math::SparseMatrix< T, A >
, CDPL::Math::SparseVector< T, A >
, CDPL::Math::Vector< T, A >
- ConstPropertyIterator
: CDPL::Base::PropertyContainer
- ConstraintFunction
: CDPL::Pharm::InteractionAnalyzer
, CDPL::Pharm::InteractionConstraintConnector
- ConstReactionSiteIterator
: CDPL::Chem::Reactor
- ConstRecordIterator
: CDPL::Biomol::PDBData
- ConstReference
: CDPL::Math::BoundedMatrix< T, M, N >
, CDPL::Math::BoundedVector< T, N >
, CDPL::Math::CMatrix< T, M, N >
, CDPL::Math::ComplexTraits< T >
, CDPL::Math::CVector< T, N >
, CDPL::Math::Grid< T, A >
, CDPL::Math::GridBinary1< E1, E2, F >
, CDPL::Math::GridReference< G >
, CDPL::Math::GridUnary< E, F >
, CDPL::Math::HomogenousCoordsAdapter< V >
, CDPL::Math::IdentityMatrix< T >
, CDPL::Math::InitListMatrix< T >
, CDPL::Math::InitListVector< T >
, CDPL::Math::Matrix1VectorBinary< E1, E2, F >
, CDPL::Math::Matrix2VectorBinary< E1, E2, F >
, CDPL::Math::Matrix< T, A >
, CDPL::Math::MatrixBinary1< E1, E2, F >
, CDPL::Math::MatrixBinary2< E1, E2, F >
, 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::MatrixUnary< E, F >
, CDPL::Math::Quaternion< T >
, CDPL::Math::QuaternionBinary1< E1, E2, F >
, CDPL::Math::QuaternionBinary2< E1, E2, F >
, CDPL::Math::QuaternionReference< Q >
, CDPL::Math::QuaternionUnary1< E, F >
, CDPL::Math::QuaternionUnary2< E, F >
, CDPL::Math::QuaternionVectorAdapter< Q >
, CDPL::Math::QuaternionVectorBinary< E1, E2, F >
, CDPL::Math::RealQuaternion< T >
, CDPL::Math::RegularSpatialGrid< T, C, GD, XF >
, CDPL::Math::RotationMatrix< T >
, CDPL::Math::Scalar13QuaternionTernary< E1, E2, E3, F >
, CDPL::Math::Scalar1GridBinary< E1, E2, F >
, CDPL::Math::Scalar1MatrixBinary< E1, E2, F >
, CDPL::Math::Scalar1QuaternionBinary1< E1, E2, F >
, CDPL::Math::Scalar1QuaternionBinary2< E1, E2, F >
, CDPL::Math::Scalar1VectorBinary< E1, E2, F >
, CDPL::Math::Scalar2GridBinary< E1, E2, F >
, CDPL::Math::Scalar2MatrixBinary< E1, E2, F >
, CDPL::Math::Scalar2QuaternionBinary1< E1, E2, F >
, CDPL::Math::Scalar2QuaternionBinary2< E1, E2, F >
, CDPL::Math::Scalar2VectorBinary< E1, E2, F >
, CDPL::Math::Scalar3QuaternionTernary< E1, E2, E3, F >
, CDPL::Math::ScalarGrid< T >
, CDPL::Math::ScalarMatrix< T >
, CDPL::Math::ScalarTraits< T >
, CDPL::Math::ScalarVector< T >
, CDPL::Math::ScalingMatrix< T >
, CDPL::Math::SparseContainerElement< C, K >
, CDPL::Math::SparseMatrix< T, A >
, CDPL::Math::SparseVector< T, A >
, CDPL::Math::TranslationMatrix< T >
, CDPL::Math::TriangularAdapter< M, Tri >
, CDPL::Math::UnitVector< T >
, CDPL::Math::Vector< T, A >
, CDPL::Math::VectorBinary1< E1, E2, F >
, CDPL::Math::VectorBinary2< E1, E2, F >
, CDPL::Math::VectorMatrixBinary< E1, E2, F >
, CDPL::Math::VectorMatrixUnary< E, F >
, CDPL::Math::VectorQuaternionAdapter< V >
, CDPL::Math::VectorRange< V >
, CDPL::Math::VectorReference< V >
, CDPL::Math::VectorSlice< V >
, CDPL::Math::VectorUnary< E, F >
, CDPL::Math::ZeroGrid< T >
, CDPL::Math::ZeroMatrix< T >
, CDPL::Math::ZeroVector< T >
- ConstResultIterator
: CDPL::Shape::FastGaussianShapeAlignment
, CDPL::Shape::GaussianShapeAlignment
, CDPL::Shape::GaussianShapeFunctionAlignment
- ConstReverseElementIterator
: CDPL::Util::Array< ValueType >
, CDPL::Util::IndirectArray< ValueType, PointerType, NullPointerCheck >
- ConstReverseEntryIterator
: CDPL::Util::Map< Key, Value, AllowDefValues, KeyCompFunc >
, CDPL::Util::MultiMap< Key, Value, AllowDefValues, KeyCompFunc >
- ConstructorFunction
: CDPL::Util::ObjectPool< T >
, CDPL::Util::ObjectStack< T >
- ConstRuleIterator
: CDPL::ConfGen::TorsionCategory
- ConstShapeIterator
: CDPL::Shape::GaussianShapeAlignment
- ConstStereoCenterDataIterator
: CDPL::ConfGen::DGConstraintGenerator
- ConstStructureDataIterator
: CDPL::Chem::ResonanceStructureGenerator
- ConstVolumeConstraintIterator
: CDPL::Util::DGCoordinatesGenerator< 3, T >
- ContainerType
: CDPL::Math::GridContainer< C >
, CDPL::Math::MatrixContainer< C >
, CDPL::Math::QuaternionContainer< C >
, CDPL::Math::SparseContainerElement< C, K >
, CDPL::Math::VectorContainer< C >
- contains()
: CDPL::Chem::ElectronSystem
- containsAtom()
: CDPL::Chem::Atom
, CDPL::Chem::AtomContainer
, CDPL::Chem::BasicAtom
, CDPL::Chem::BasicBond
, CDPL::Chem::BasicMolecule
, CDPL::Chem::Bond
, CDPL::Chem::ElectronSystem
, CDPL::Chem::Fragment
, CDPL::Chem::Molecule
, CDPL::ConfGen::CanonicalFragment
- containsBond()
: CDPL::Chem::Atom
, CDPL::Chem::BasicAtom
, CDPL::Chem::BasicMolecule
, CDPL::Chem::BondContainer
, CDPL::Chem::Fragment
, CDPL::Chem::Molecule
, CDPL::ConfGen::CanonicalFragment
- containsComponent()
: CDPL::Chem::BasicReaction
, CDPL::Chem::Reaction
- containsEntry()
: CDPL::Biomol::ResidueDictionary
, CDPL::Chem::AtomDictionary
, CDPL::ConfGen::FragmentLibrary
, CDPL::Util::Map< Key, Value, AllowDefValues, KeyCompFunc >
- containsFeature()
: CDPL::Pharm::BasicPharmacophore
, CDPL::Pharm::FeatureContainer
, CDPL::Pharm::FeatureSet
, CDPL::Pharm::Pharmacophore
- containsLocalPoint()
: CDPL::Math::RegularSpatialGrid< T, C, GD, XF >
- containsPoint()
: CDPL::Math::RegularSpatialGrid< T, C, GD, XF >
, CDPL::Vis::Line2D
, CDPL::Vis::Rectangle2D
- containsRecord()
: CDPL::Biomol::PDBData
- containsRectangle()
: CDPL::Vis::Rectangle2D
- ControlParameterContainer()
: CDPL::Base::ControlParameterContainer
- ControlParameterList()
: CDPL::Base::ControlParameterList
- convert()
: CDPL::Vis::Path2D
- CoordinatesTransformType
: CDPL::Math::RegularSpatialGrid< T, C, GD, XF >
- CoordinatesType
: CDPL::Grid::RegularGrid< T, CVT >
, CDPL::Grid::SpatialGrid< T, CVT >
- CoordinatesValueType
: CDPL::Grid::RegularGrid< T, CVT >
, CDPL::Grid::SpatialGrid< T, CVT >
, CDPL::Math::RegularSpatialGrid< T, C, GD, XF >
- COORDS_DIM
: CDPL::Util::DGCoordinatesGeneratorBase< Dim, T, Derived >
- copy()
: CDPL::Chem::BasicMolecule
, CDPL::Chem::BasicReaction
, CDPL::Chem::Molecule
, CDPL::Chem::Reaction
, CDPL::Pharm::BasicPharmacophore
, CDPL::Pharm::Pharmacophore
- copyParameters()
: CDPL::Base::ControlParameterContainer
- CopyPostprocessingFunction
: CDPL::Chem::Molecule
, CDPL::Chem::Reaction
- copyProperties()
: CDPL::Base::PropertyContainer
- create()
: CDPL::Base::LookupKey
, CDPL::ConfGen::CanonicalFragment
- CREATE
: CDPL::Pharm::ScreeningDBCreator
- createCairoSurface()
: CDPL::Vis::ImageWriter
- createQBrush()
: CDPL::Vis::QtObjectFactory
- createQColor()
: CDPL::Vis::QtObjectFactory
- createQFont()
: CDPL::Vis::QtObjectFactory
- createQPainterPath()
: CDPL::Vis::QtObjectFactory
- createQPen()
: CDPL::Vis::QtObjectFactory
- createReader()
: CDPL::Base::DataInputHandler< T >
, CDPL::Pharm::PSDMoleculeInputHandler
, CDPL::Pharm::PSDPharmacophoreInputHandler
, CDPL::Util::DefaultDataInputHandler< ReaderImpl, Format, DataType >
- createWriter()
: CDPL::Base::DataOutputHandler< T >
, CDPL::Pharm::PSDMolecularGraphOutputHandler
, CDPL::Util::DefaultDataOutputHandler< WriterImpl, FORMAT, DataType >
- CROSS_PATTERN
: CDPL::Vis::Brush
- CRYST1
: CDPL::Biomol::PDBData
- CustomSetupFunction
: CDPL::Chem::TautomerGenerator
- CVector()
: CDPL::Math::CVector< T, N >
- CYAN
: CDPL::Vis::Color
- CyclicSubstructure()
: CDPL::Chem::CyclicSubstructure