Chemical Data Processing Library C++ API - Version 1.1.1
File List
Here is a list of all files with brief descriptions:
 AffineTransform.hppMatrix types for various affine transformations
 Alignment.hppDefinition of constants in namespace CDPL::Vis::Alignment
 AlignmentResult.hppDefinition of the class CDPL::Shape::AlignmentResult
 AlignmentResultSelectionMode.hppDefinition of constants in namespace CDPL::Shape::AlignmentResultSelectionMode
 AmideImidicAcidTautomerization.hppDefinition of the class CDPL::Chem::AmideImidicAcidTautomerization
 ANDMatchExpressionList.hppDefinition of the class CDPL::Chem::ANDMatchExpressionList
 Any.hppDefinition of the class CDPL::Base::Any
 APIPrefix.hppDefinition of the preprocessor macros CDPL_API_IMPORT and CDPL_API_EXPORT
 Base/APIPrefix.hppDefinition of the preprocessor macro CDPL_BASE_API
 Biomol/APIPrefix.hppDefinition of the preprocessor macro CDPL_BIOMOL_API
 Chem/APIPrefix.hppDefinition of the preprocessor macro CDPL_CHEM_API
 ConfGen/APIPrefix.hppDefinition of the preprocessor macro CDPL_CONFGEN_API
 Descr/APIPrefix.hppDefinition of the preprocessor macro CDPL_DESCR_API
 ForceField/APIPrefix.hppDefinition of the preprocessor macro CDPL_FORCEFIELD_API
 GRAIL/APIPrefix.hppDefinition of the preprocessor macro CDPL_GRAIL_API
 Grid/APIPrefix.hppDefinition of the preprocessor macro CDPL_GRID_API
 Math/APIPrefix.hppDefinition of the preprocessor macro CDPL_MATH_API
 MolProp/APIPrefix.hppDefinition of the preprocessor macro CDPL_MOLPROP_API
 Pharm/APIPrefix.hppDefinition of the preprocessor macro CDPL_PHARM_API
 Shape/APIPrefix.hppDefinition of the preprocessor macro CDPL_SHAPE_API
 Util/APIPrefix.hppDefinition of the preprocessor macro CDPL_UTIL_API
 Vis/APIPrefix.hppDefinition of the preprocessor macro CDPL_VIS_API
 AromaticFeatureGenerator.hppDefinition of the class CDPL::Pharm::AromaticFeatureGenerator
 AromaticRingSet.hppDefinition of the class CDPL::Chem::AromaticRingSet
 AromaticSSSRSubset.hppDefinition of the class CDPL::Chem::AromaticSSSRSubset
 AromaticSubstructure.hppDefinition of the class CDPL::Chem::AromaticSubstructure
 Array.hppDefinition of the class CDPL::Util::Array
 ArrowStyle.hppDefinition of constants in namespace CDPL::Vis::ArrowStyle
 Atom.hppDefinition of the class CDPL::Chem::Atom
 Atom2DCoordinatesCalculator.hppDefinition of the class CDPL::Chem::Atom2DCoordinatesCalculator
 Atom3DCoordinatesFunction.hppType definition of a generic wrapper class for storing user-defined Chem::Atom 3D-coordinates functions
 Atom3DCoordinatesFunctor.hppDefinition of the class CDPL::Chem::Atom3DCoordinatesFunctor
 AtomArray3DCoordinatesFunctor.hppDefinition of the class CDPL::Chem::AtomArray3DCoordinatesFunctor
 AtomAutoCorrelation3DVectorCalculator.hppDefinition of the class CDPL::Descr::AtomAutoCorrelation3DVectorCalculator
 AtomBondMapping.hppDefinition of the class CDPL::Chem::AtomBondMapping
 AtomColorTable.hppProvides the contents of namespace CDPL::Vis::AtomColorTable
 AtomCompareFunction.hppType definition of a generic wrapper class for storing user-defined Chem::Atom compare functions
 AtomConfiguration.hppDefinition of constants in namespace CDPL::Chem::AtomConfiguration
 AtomConfigurationMatchExpression.hppDefinition of the class CDPL::Chem::AtomConfigurationMatchExpression
 AtomConformer3DCoordinatesFunctor.hppDefinition of the class CDPL::Chem::AtomConformer3DCoordinatesFunctor
 AtomContainer.hppDefinition of the class CDPL::Chem::AtomContainer
 Chem/AtomContainerFunctions.hppDeclaration of functions that operate on Chem::AtomContainer instances
 Descr/AtomContainerFunctions.hppDeclaration of functions that operate on Chem::AtomContainer instances
 MolProp/AtomContainerFunctions.hppDeclaration of functions that operate on Chem::AtomContainer instances
 AtomDensityGridCalculator.hppDefinition of the class CDPL::GRAIL::AtomDensityGridCalculator
 AtomDictionary.hppDefinition of the class CDPL::Chem::AtomDictionary
 AtomEnvironmentMatchExpression.hppDefinition of the class CDPL::Chem::AtomEnvironmentMatchExpression
 Biomol/AtomFunctions.hppDeclaration of functions that operate on Chem::Atom instances
 Chem/AtomFunctions.hppDeclaration of functions that operate on Chem::Atom instances
 ForceField/AtomFunctions.hppDeclaration of functions that operate on Chem::Atom instances
 MolProp/AtomFunctions.hppDeclaration of functions that operate on Chem::Atom instances
 Vis/AtomFunctions.hppDeclaration of functions that operate on Chem::Atom instances
 AtomHydrophobicityCalculator.hppDefinition of the class CDPL::MolProp::AtomHydrophobicityCalculator
 AtomMapping.hppDefinition of the type CDPL::Chem::AtomMapping
 AtomMatchConstraint.hppDefinition of constants in namespace CDPL::Chem::AtomMatchConstraint
 AtomPredicate.hppType definition of a generic wrapper class for storing user-defined Chem::Atom predicates
 AtomPriorityFunction.hppType definition of a generic wrapper class for storing user-defined Chem::Atom 3D-coordinates functions
 Biomol/AtomProperty.hppDefinition of constants in namespace CDPL::Biomol::AtomProperty
 Chem/AtomProperty.hppDefinition of constants in namespace CDPL::Chem::AtomProperty
 ForceField/AtomProperty.hppDefinition of constants in namespace CDPL::ForceField::AtomProperty
 MolProp/AtomProperty.hppDefinition of constants in namespace CDPL::MolProp::AtomProperty
 Vis/AtomProperty.hppDefinition of constants in namespace CDPL::Vis::AtomProperty
 Biomol/AtomPropertyDefault.hppDefinition of constants in namespace CDPL::Biomol::AtomPropertyDefault
 Chem/AtomPropertyDefault.hppDefinition of constants in namespace CDPL::Chem::AtomPropertyDefault
 MolProp/AtomPropertyDefault.hppDefinition of constants in namespace CDPL::MolProp::AtomPropertyDefault
 Vis/AtomPropertyDefault.hppDefinition of constants in namespace CDPL::Chem::AtomPropertyDefault
 Biomol/AtomPropertyFlag.hppDefinition of constants in namespace CDPL::Biomol::AtomPropertyFlag
 Chem/AtomPropertyFlag.hppDefinition of constants in namespace CDPL::Chem::AtomPropertyFlag
 AtomRDFCodeCalculator.hppDefinition of the class CDPL::Descr::AtomRDFCodeCalculator
 AtomSSSRRingSizeMatchExpression.hppDefinition of the class CDPL::Chem::AtomSSSRRingSizeMatchExpression
 AtomType.hppDefinition of constants in namespace CDPL::Chem::AtomType
 AtomTypeMatchExpression.hppDefinition of the class CDPL::Chem::AtomTypeMatchExpression
 AttributedGrid.hppDefinition of a grid data type
 GRAIL/AttributedGridFunctions.hppDeclaration of functions that operate on Grid::AttributedGrid instances
 Grid/AttributedGridFunctions.hppDeclaration of functions that operate on Grid::AttributedGrid instances
 GRAIL/AttributedGridProperty.hppDefinition of constants in namespace CDPL::GRAIL::AttributedGridProperty
 Grid/AttributedGridProperty.hppDefinition of constants in namespace CDPL::Grid::AttributedGridProperty
 GRAIL/AttributedGridPropertyDefault.hppDefinition of constants in namespace CDPL::GRAIL::AttributedGridPropertyDefault
 Grid/AttributedGridPropertyDefault.hppDefinition of constants in namespace CDPL::Grid::AttributedGridPropertyDefault
 AutoCorrelation2DVectorCalculator.hppDefinition of the class CDPL::Descr::AutoCorrelation2DVectorCalculator
 AutoCorrelation3DVectorCalculator.hppDefinition of the class CDPL::Descr::AutoCorrelation3DVectorCalculator
 AutomorphismGroupSearch.hppDefinition of the class CDPL::Chem::AutomorphismGroupSearch
 Base.hppA convenience header including everything that is defined in namespace CDPL::Base
 BasicAtom.hppDefinition of the class CDPL::Chem::BasicAtom
 BasicBond.hppDefinition of the class CDPL::Chem::BasicBond
 BasicFeature.hppDefinition of the class CDPL::Pharm::BasicFeature
 BasicMolecule.hppDefinition of the class CDPL::Chem::BasicMolecule
 BasicPharmacophore.hppDefinition of the class CDPL::Pharm::BasicPharmacophore
 BasicReaction.hppDefinition of the class CDPL::Chem::BasicReaction
 BCUTDescriptorCalculator.hppDefinition of the class CDPL::Descr::BCUTDescriptorCalculator
 BemisMurckoAnalyzer.hppDefinition of the class CDPL::Chem::BemisMurckoAnalyzer
 BFGSMinimizer.hppImplementation of the BFGS optimization algorithm
 BindingAffinityCalculator.hppDefinition of the class CDPL::GRAIL::BindingAffinityCalculator
 Biomol.hppA convenience header including everything that is defined in namespace CDPL::Biomol
 BitSet.hppDefinition of the type CDPL::Util::BitSet
 Bond.hppDefinition of the class CDPL::Chem::Bond
 BondCompareFunction.hppType definition of a generic wrapper class for storing user-defined Chem::Bond compare functions
 BondConfiguration.hppDefinition of constants in namespace CDPL::Chem::BondConfiguration
 BondConfigurationMatchExpression.hppDefinition of the class CDPL::Chem::BondConfigurationMatchExpression
 BondContainer.hppDefinition of the class CDPL::Chem::BondContainer
 BondContainerFunctions.hppDeclaration of functions that operate on Chem::BondContainer instances
 BondDirection.hppDefinition of constants in namespace CDPL::Chem::BondDirection
 BondDirectionMatchExpression.hppDefinition of the class CDPL::Chem::BondDirectionMatchExpression
 Chem/BondFunctions.hppDeclaration of functions that operate on Chem::Bond instances
 ConfGen/BondFunctions.hppDeclaration of functions that operate on Chem::Bond instances
 ForceField/BondFunctions.hppDeclaration of functions that operate on Chem::Bond instances
 MolProp/BondFunctions.hppDeclaration of functions that operate on Chem::Bond instances
 Vis/BondFunctions.hppDeclaration of functions that operate on Chem::Bond instances
 BondMapping.hppDefinition of the type CDPL::Chem::BondMapping
 BondMatchConstraint.hppDefinition of constants in namespace CDPL::Chem::BondMatchConstraint
 BondOrderCalculator.hppDefinition of the class CDPL::Chem::BondOrderCalculator
 BondPredicate.hppType definition of a generic wrapper class for storing user-defined Chem::Bond predicates
 Chem/BondProperty.hppDefinition of constants in namespace CDPL::Chem::BondProperty
 ForceField/BondProperty.hppDefinition of constants in namespace CDPL::ForceField::BondProperty
 MolProp/BondProperty.hppDefinition of constants in namespace CDPL::MolProp::BondProperty
 Vis/BondProperty.hppDefinition of constants in namespace CDPL::Vis::BondProperty
 Chem/BondPropertyDefault.hppDefinition of constants in namespace CDPL::Chem::BondPropertyDefault
 Vis/BondPropertyDefault.hppDefinition of constants in namespace CDPL::Chem::BondPropertyDefault
 BondPropertyFlag.hppDefinition of constants in namespace CDPL::Chem::BondPropertyFlag
 BondReactionCenterStatusMatchExpression.hppDefinition of the class CDPL::Chem::BondReactionCenterStatusMatchExpression
 BondStereoFlag.hppDefinition of constants in namespace CDPL::Chem::BondStereoFlag
 BondStereoFlagCalculator.hppDefinition of the class CDPL::Chem::BondStereoFlagCalculator
 BondSubstituentDirectionMatchExpression.hppDefinition of the class CDPL::Chem::BondSubstituentDirectionMatchExpression
 BRICSAtomLabel.hppDefinition of constants in namespace CDPL::Chem::BRICSAtomLabel
 BRICSFragmentGenerator.hppDefinition of the class CDPL::Chem::BRICSFragmentGenerator
 BRICSRuleID.hppDefinition of constants in namespace CDPL::Chem::BRICSRuleID
 BronKerboschAlgorithm.hppImplementation of the Bron-Kerbosch algorithm
 Brush.hppDefinition of the class CDPL::Vis::Brush
 BuildInfo.hppProvides CDPKit build system and build time information
 BurdenMatrixGenerator.hppDefinition of the class CDPL::Descr::BurdenMatrixGenerator
 BuriednessGridCalculator.hppDefinition of the class CDPL::GRAIL::BuriednessGridCalculator
 BuriednessScore.hppDefinition of the class CDPL::GRAIL::BuriednessScore
 CairoFontMetrics.hppDefinition of the class CDPL::Vis::CairoFontMetrics
 CairoPointer.hppDefinition of the class CDPL::Vis::CairoPointer
 CairoRenderer2D.hppDefinition of the class CDPL::Vis::CairoRenderer2D
 CallbackFunction.hppType definition of a generic wrapper class for storing user-defined callback functions
 CanonicalFragment.hppDefinition of the class CDPL::ConfGen::CanonicalFragment
 CanonicalNumberingCalculator.hppDefinition of the class CDPL::Chem::CanonicalNumberingCalculator
 CationPiInteractionConstraint.hppDefinition of the class CDPL::Pharm::CationPiInteractionConstraint
 CationPiInteractionScore.hppDefinition of the class CDPL::Pharm::CationPiInteractionScore
 CDFBZ2DRegularGridInputHandler.hppDefinition of the class CDPL::Grid::CDFBZ2DRegularGridInputHandler
 CDFBZ2DRegularGridOutputHandler.hppDefinition of the class CDPL::Grid::CDFBZ2DRegularGridOutputHandler
 CDFBZ2DRegularGridReader.hppDefinition of the class CDPL::Grid::CDFBZ2DRegularGridReader
 CDFBZ2DRegularGridSetInputHandler.hppDefinition of the class CDPL::Grid::CDFBZ2DRegularGridSetInputHandler
 CDFBZ2DRegularGridSetOutputHandler.hppDefinition of the class CDPL::Grid::CDFBZ2DRegularGridSetOutputHandler
 CDFBZ2DRegularGridSetReader.hppDefinition of the class CDPL::Grid::CDFBZ2DRegularGridSetReader
 CDFBZ2DRegularGridSetWriter.hppDefinition of the class CDPL::Grid::CDFBZ2DRegularGridSetWriter
 CDFBZ2DRegularGridWriter.hppDefinition of the class CDPL::Grid::CDFBZ2DRegularGridWriter
 CDFBZ2FeatureContainerOutputHandler.hppDefinition of the class CDPL::Pharm::CDFBZ2FeatureContainerOutputHandler
 CDFBZ2FeatureContainerWriter.hppDefinition of the class CDPL::Pharm::CDFBZ2FeatureContainerWriter
 CDFBZ2MolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::CDFBZ2MolecularGraphOutputHandler
 CDFBZ2MolecularGraphWriter.hppDefinition of the class CDPL::Chem::CDFBZ2MolecularGraphWriter
 CDFBZ2MoleculeInputHandler.hppDefinition of the class CDPL::Chem::CDFBZ2MoleculeInputHandler
 CDFBZ2MoleculeReader.hppDefinition of the class CDPL::Chem::CDFBZ2MoleculeReader
 CDFBZ2PharmacophoreInputHandler.hppDefinition of the class CDPL::Pharm::CDFBZ2PharmacophoreInputHandler
 CDFBZ2PharmacophoreReader.hppDefinition of the class CDPL::Pharm::CDFBZ2PharmacophoreReader
 CDFBZ2ReactionInputHandler.hppDefinition of the class CDPL::Chem::CDFBZ2ReactionInputHandler
 CDFBZ2ReactionOutputHandler.hppDefinition of the class CDPL::Chem::CDFBZ2ReactionOutputHandler
 CDFBZ2ReactionReader.hppDefinition of the class CDPL::Chem::CDFBZ2ReactionReader
 CDFBZ2ReactionWriter.hppDefinition of the class CDPL::Chem::CDFBZ2ReactionWriter
 CDFDRegularGridInputHandler.hppDefinition of the class CDPL::Grid::CDFDRegularGridInputHandler
 CDFDRegularGridOutputHandler.hppDefinition of the class CDPL::Grid::CDFDRegularGridOutputHandler
 CDFDRegularGridReader.hppDefinition of the class CDPL::Grid::CDFDRegularGridReader
 CDFDRegularGridSetInputHandler.hppDefinition of the class CDPL::Grid::CDFDRegularGridSetInputHandler
 CDFDRegularGridSetOutputHandler.hppDefinition of the class CDPL::Grid::CDFDRegularGridSetOutputHandler
 CDFDRegularGridSetReader.hppDefinition of the class CDPL::Grid::CDFDRegularGridSetReader
 CDFDRegularGridSetWriter.hppDefinition of the class CDPL::Grid::CDFDRegularGridSetWriter
 CDFDRegularGridWriter.hppDefinition of the class CDPL::Grid::CDFDRegularGridWriter
 CDFFeatureContainerOutputHandler.hppDefinition of the class CDPL::Pharm::CDFFeatureContainerOutputHandler
 CDFFeatureContainerWriter.hppDefinition of the class CDPL::Pharm::CDFFeatureContainerWriter
 CDFGZDRegularGridInputHandler.hppDefinition of the class CDPL::Grid::CDFGZDRegularGridInputHandler
 CDFGZDRegularGridOutputHandler.hppDefinition of the class CDPL::Grid::CDFGZDRegularGridOutputHandler
 CDFGZDRegularGridReader.hppDefinition of the class CDPL::Grid::CDFGZDRegularGridReader
 CDFGZDRegularGridSetInputHandler.hppDefinition of the class CDPL::Grid::CDFGZDRegularGridSetInputHandler
 CDFGZDRegularGridSetOutputHandler.hppDefinition of the class CDPL::Grid::CDFGZDRegularGridSetOutputHandler
 CDFGZDRegularGridSetReader.hppDefinition of the class CDPL::Grid::CDFGZDRegularGridSetReader
 CDFGZDRegularGridSetWriter.hppDefinition of the class CDPL::Grid::CDFGZDRegularGridSetWriter
 CDFGZDRegularGridWriter.hppDefinition of the class CDPL::Grid::CDFGZDRegularGridWriter
 CDFGZFeatureContainerOutputHandler.hppDefinition of the class CDPL::Pharm::CDFGZFeatureContainerOutputHandler
 CDFGZFeatureContainerWriter.hppDefinition of the class CDPL::Pharm::CDFGZFeatureContainerWriter
 CDFGZMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::CDFGZMolecularGraphOutputHandler
 CDFGZMolecularGraphWriter.hppDefinition of the class CDPL::Chem::CDFGZMolecularGraphWriter
 CDFGZMoleculeInputHandler.hppDefinition of the class CDPL::Chem::CDFGZMoleculeInputHandler
 CDFGZMoleculeReader.hppDefinition of the class CDPL::Chem::CDFGZMoleculeReader
 CDFGZPharmacophoreInputHandler.hppDefinition of the class CDPL::Pharm::CDFGZPharmacophoreInputHandler
 CDFGZPharmacophoreReader.hppDefinition of the class CDPL::Pharm::CDFGZPharmacophoreReader
 CDFGZReactionInputHandler.hppDefinition of the class CDPL::Chem::CDFGZReactionInputHandler
 CDFGZReactionOutputHandler.hppDefinition of the class CDPL::Chem::CDFGZReactionOutputHandler
 CDFGZReactionReader.hppDefinition of the class CDPL::Chem::CDFGZReactionReader
 CDFGZReactionWriter.hppDefinition of the class CDPL::Chem::CDFGZReactionWriter
 CDFMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::CDFMolecularGraphOutputHandler
 CDFMolecularGraphWriter.hppDefinition of the class CDPL::Chem::CDFMolecularGraphWriter
 CDFMoleculeInputHandler.hppDefinition of the class CDPL::Chem::CDFMoleculeInputHandler
 CDFMoleculeReader.hppDefinition of the class CDPL::Chem::CDFMoleculeReader
 CDFPharmacophoreInputHandler.hppDefinition of the class CDPL::Pharm::CDFPharmacophoreInputHandler
 CDFPharmacophoreReader.hppDefinition of the class CDPL::Pharm::CDFPharmacophoreReader
 CDFReactionInputHandler.hppDefinition of the class CDPL::Chem::CDFReactionInputHandler
 CDFReactionOutputHandler.hppDefinition of the class CDPL::Chem::CDFReactionOutputHandler
 CDFReactionReader.hppDefinition of the class CDPL::Chem::CDFReactionReader
 CDFReactionWriter.hppDefinition of the class CDPL::Chem::CDFReactionWriter
 CFLMoleculeInputHandler.hppDefinition of the class CDPL::ConfGen::CFLMoleculeInputHandler
 CFLMoleculeReader.hppDefinition of the class CDPL::ConfGen::CFLMoleculeReader
 Check.hppDefinition of various preprocessor macros for error checking
 Chem.hppA convenience header including everything that is defined in namespace CDPL::Chem
 ChEMBLStandardizer.hppDefinition of the class CDPL::Chem::ChEMBLStandardizer
 CIPConfigurationLabeler.hppDefinition of the class CDPL::Chem::CIPConfigurationLabeler
 CIPDescriptor.hppDefinition of constants in namespace CDPL::Chem::CIPDescriptor
 CIPPriorityCalculator.hppDefinition of the class CDPL::Chem::CIPPriorityCalculator
 CircularFingerprintGenerator.hppDefinition of the class CDPL::Descr::CircularFingerprintGenerator
 ClipPathPrimitive2D.hppDefinition of the class CDPL::Vis::ClipPathPrimitive2D
 Color.hppDefinition of the class CDPL::Vis::Color
 ColorTable.hppDefinition of the type CDPL::Vis::ColorTable
 CommonConnectedSubstructureSearch.hppDefinition of the class CDPL::Chem::CommonConnectedSubstructureSearch
 CommonType.hppCommon type deduction
 CompleteRingSet.hppDefinition of the class CDPL::Chem::CompleteRingSet
 ComponentSet.hppDefinition of the class CDPL::Chem::ComponentSet
 CompoundDataReader.hppDefinition of the class CDPL::Util::CompoundDataReader
 CompressedDataReader.hppDefinition of the class CDPL::Util::CompressedDataReader
 CompressedDataWriter.hppDefinition of the class CDPL::Util::CompressedDataWriter
 CompressionStreams.hppProvides I/O-streams capable of performing compression and decompression
 ConfGen.hppA convenience header including everything that is defined in namespace CDPL::ConfGen
 Config.hppProvides CDPKit build configuration information
 ConformerData.hppDefinition of the class CDPL::ConfGen::ConformerData
 ConformerDataArray.hppDefinition of the type CDPL::ConfGen::ConformerDataArray
 ConformerGenerator.hppDefinition of the class CDPL::ConfGen::ConformerGenerator
 ConformerGeneratorSettings.hppDefinition of the class CDPL::ConfGen::ConformerGeneratorSettings
 ConformerSamplingMode.hppDefinition of constants in namespace CDPL::ConfGen::ConformerSamplingMode
 ConnectedSubstructureSet.hppDefinition of the class CDPL::Chem::ConnectedSubstructureSet
 Biomol/ControlParameter.hppDefinition of constants in namespace CDPL::Biomol::ControlParameter
 Chem/ControlParameter.hppDefinition of constants in namespace CDPL::Chem::ControlParameter
 ConfGen/ControlParameter.hppDefinition of constants in namespace CDPL::ConfGen::ControlParameter
 Grid/ControlParameter.hppDefinition of constants in namespace CDPL::Grid::ControlParameter
 Pharm/ControlParameter.hppDefinition of constants in namespace CDPL::Pharm::ControlParameter
 Vis/ControlParameter.hppDefinition of constants in namespace CDPL::Vis::ControlParameter
 ControlParameterContainer.hppDefinition of the class CDPL::Base::ControlParameterContainer
 Biomol/ControlParameterDefault.hppDefinition of constants in namespace CDPL::Biomol::ControlParameterDefault
 Chem/ControlParameterDefault.hppDefinition of constants in namespace CDPL::Chem::ControlParameterDefault
 ConfGen/ControlParameterDefault.hppDefinition of constants in namespace CDPL::ConfGen::ControlParameterDefault
 Grid/ControlParameterDefault.hppDefinition of constants in namespace CDPL::Grid::ControlParameterDefault
 Pharm/ControlParameterDefault.hppDefinition of constants in namespace CDPL::Pharm::ControlParameterDefault
 Vis/ControlParameterDefault.hppDefinition of constants in namespace CDPL::Vis::ControlParameterDefault
 Biomol/ControlParameterFunctions.hppDeclaration of convenience functions for control-parameter handling
 Chem/ControlParameterFunctions.hppDeclaration of convenience functions for control-parameter handling
 ConfGen/ControlParameterFunctions.hppDeclaration of convenience functions for control-parameter handling
 Grid/ControlParameterFunctions.hppDeclaration of convenience functions for control-parameter handling
 Pharm/ControlParameterFunctions.hppDeclaration of convenience functions for control-parameter handling
 Vis/ControlParameterFunctions.hppDeclaration of convenience functions for control-parameter handling
 ControlParameterList.hppDefinition of the class CDPL::Base::ControlParameterList
 CoordinationGeometry.hppDefinition of constants in namespace CDPL::MolProp::CoordinationGeometry
 CyclicSubstructure.hppDefinition of the class CDPL::Chem::CyclicSubstructure
 Base/DataFormat.hppDefinition of the class CDPL::Base::DataFormat
 Biomol/DataFormat.hppProvides the contents of namespace CDPL::Biomol::DataFormat
 Chem/DataFormat.hppProvides the contents of namespace CDPL::Chem::DataFormat
 ConfGen/DataFormat.hppProvides the contents of namespace CDPL::ConfGen::DataFormat
 Grid/DataFormat.hppProvides the contents of namespace CDPL::Grid::DataFormat
 Pharm/DataFormat.hppProvides the contents of namespace CDPL::Pharm::DataFormat
 Vis/DataFormat.hppDefinition of constants in namespace CDPL::Vis::DataFormat
 DataInputHandler.hppDefinition of the class CDPL::Base::DataInputHandler
 DataIOBase.hppDefinition of the class CDPL::Base::DataIOBase
 DataIOManager.hppDefinition of the class CDPL::Base::DataIOManager
 DataOutputHandler.hppDefinition of the class CDPL::Base::DataOutputHandler
 DataReader.hppDefinition of the class CDPL::Base::DataReader
 DataWriter.hppDefinition of the class CDPL::Base::DataWriter
 DefaultDataInputHandler.hppDefinition of the class CDPL::Util::DefaultDataInputHandler
 DefaultDataOutputHandler.hppDefinition of the class CDPL::Util::DefaultDataOutputHandler
 DefaultInteractionAnalyzer.hppDefinition of the class CDPL::Pharm::DefaultInteractionAnalyzer
 DefaultMultiConfMoleculeInputProcessor.hppDefinition of the class CDPL::Chem::DefaultMultiConfMoleculeInputProcessor
 DefaultPharmacophoreGenerator.hppDefinition of the class CDPL::Pharm::DefaultPharmacophoreGenerator
 DefaultTautomerGenerator.hppDefinition of the class CDPL::Chem::DefaultTautomerGenerator
 Dereferencer.hppDefinition of the classes CDPL::Util::Dereferencer and CDPL::Util::NullCheckDereferencer
 Descr.hppA convenience header including everything that is defined in namespace CDPL::Descr
 DGConstraintGenerator.hppDefinition of the class CDPL::ConfGen::DGConstraintGenerator
 DGConstraintGeneratorSettings.hppDefinition of the class CDPL::ConfGen::DGConstraintGeneratorSettings
 DGCoordinatesGenerator.hppImplementation of a distance geometry based coordinates generator
 DGStructureGenerator.hppDefinition of the class CDPL::ConfGen::DGStructureGenerator
 DGStructureGeneratorSettings.hppDefinition of the class CDPL::ConfGen::DGStructureGeneratorSettings
 DirectAssignmentProxy.hppDefinition of a proxy type for direct assignment of vector and matrix expressions
 DRegularGridReader.hppDefinition of the class CDPL::Grid::DRegularGridReader
 DRegularGridSetReader.hppDefinition of the class CDPL::Grid::DRegularGridSetReader
 DRegularGridSetWriter.hppDefinition of the class CDPL::Grid::DRegularGridSetWriter
 DRegularGridWriter.hppDefinition of the class CDPL::Grid::DRegularGridWriter
 ElasticPotential.hppDefinition of the class CDPL::ForceField::ElasticPotential
 ElasticPotentialFunctions.hppFunctions for the calculation of force fieldelastic potential energies and gradients
 ElasticPotentialList.hppDefinition of the class CDPL::ForceField::ElasticPotentialList
 ElectronSystem.hppDefinition of the class CDPL::Chem::ElectronSystem
 ElectronSystemList.hppDefinition of the class CDPL::Chem::ElectronSystemList
 ElementHistogram.hppDefinition of the type CDPL::MolProp::ElementHistogram
 EllipsePrimitive2D.hppDefinition of the class CDPL::Vis::EllipsePrimitive2D
 Entity3D.hppDefinition of the class CDPL::Chem::Entity3D
 Entity3DContainer.hppDefinition of the class CDPL::Chem::Entity3DContainer
 Chem/Entity3DContainerFunctions.hppDeclaration of functions that operate on Chem::Entity3DContainer instances
 Descr/Entity3DContainerFunctions.hppDeclaration of functions that operate on Chem::Entity3DContainer instances
 Entity3DCoordinatesFunction.hppType definition of a generic wrapper class for storing user-defined Chem::Entity3D coordinates functions
 Entity3DCoordinatesFunctor.hppDefinition of the class CDPL::Chem::Entity3DCoordinatesFunctor
 Entity3DFunctions.hppDeclaration of functions that operate on Chem::Entity3D instances
 Entity3DMapping.hppDefinition of the type CDPL::Chem::Entity3DMapping
 Entity3DProperty.hppDefinition of constants in namespace CDPL::Chem::Entity3DProperty
 ExactGaussianShapeOverlapFunction.hppDefinition of the class CDPL::Shape::ExactGaussianShapeOverlapFunction
 Base/Exceptions.hppDefinition of exception classes
 ForceField/Exceptions.hppDefinition of exception classes
 Expression.hppDefinition of basic expression types
 FastGaussianShapeAlignment.hppDefinition of the class CDPL::Shape::FastGaussianShapeAlignment
 FastGaussianShapeOverlapFunction.hppDefinition of the class CDPL::Shape::FastGaussianShapeOverlapFunction
 Feature.hppDefinition of the class CDPL::Pharm::Feature
 Feature3DCoordinatesFunction.hppType definition of a generic wrapper class for storing user-defined Pharm::Feature 3D-coordinates functions
 FeatureAutoCorrelation3DVectorCalculator.hppDefinition of the class CDPL::Descr::FeatureAutoCorrelation3DVectorCalculator
 FeatureContainer.hppDefinition of the class CDPL::Pharm::FeatureContainer
 FeatureContainerFunctions.hppDeclaration of functions that operate on Pharm::FeatureContainer instances
 FeatureContainerProperty.hppDefinition of constants in namespace CDPL::Pharm::FeatureContainerProperty
 FeatureContainerPropertyDefault.hppDefinition of constants in namespace CDPL::Pharm::FeatureContainerPropertyDefault
 FeatureContainerWriter.hppDefinition of the class CDPL::Pharm::FeatureContainerWriter
 FeatureDistanceConstraint.hppDefinition of the class CDPL::Pharm::FeatureDistanceConstraint
 FeatureDistanceScore.hppDefinition of the class CDPL::Pharm::FeatureDistanceScore
 GRAIL/FeatureFunctions.hppDeclaration of functions that operate on Pharm::Feature instances
 Pharm/FeatureFunctions.hppDeclaration of functions that operate on Pharm::Feature instances
 FeatureGenerator.hppDefinition of the class CDPL::Pharm::FeatureGenerator
 FeatureGeometry.hppDefinition of constants in namespace CDPL::Pharm::FeatureGeometry
 FeatureGeometryMatchFunctor.hppDefinition of the class CDPL::Pharm::FeatureGeometryMatchFunctor
 FeatureInteractionScore.hppDefinition of the class CDPL::Pharm::FeatureInteractionScore
 FeatureInteractionScoreCombiner.hppDefinition of the class CDPL::Pharm::FeatureInteractionScoreCombiner
 FeatureInteractionScoreGridCalculator.hppDefinition of the class CDPL::GRAIL::FeatureInteractionScoreGridCalculator
 FeatureMapping.hppDefinition of the type CDPL::Pharm::FeatureMapping
 FeaturePairDistanceMatchFunctor.hppDefinition of the class CDPL::Pharm::FeaturePairDistanceMatchFunctor
 FeaturePositionMatchFunctor.hppDefinition of the class CDPL::Pharm::FeaturePositionMatchFunctor
 FeatureProperty.hppDefinition of constants in namespace CDPL::Pharm::FeatureProperty
 FeaturePropertyDefault.hppDefinition of constants in namespace CDPL::Pharm::FeaturePropertyDefault
 FeatureRDFCodeCalculator.hppDefinition of the class CDPL::Descr::FeatureRDFCodeCalculator
 FeatureSet.hppDefinition of the class CDPL::Pharm::FeatureSet
 FeatureSetFunctions.hppDeclaration of functions that operate on Pharm::FeatureSet instances
 GRAIL/FeatureType.hppDefinition of constants in namespace CDPL::GRAIL::FeatureType
 Pharm/FeatureType.hppDefinition of constants in namespace CDPL::Pharm::FeatureType
 FeatureTypeHistogram.hppDefinition of the type CDPL::Pharm::FeatureTypeHistogram
 FeatureTypeMatchFunctor.hppDefinition of the class CDPL::Pharm::FeatureTypeMatchFunctor
 FileDataReader.hppDefinition of the class CDPL::Util::FileDataReader
 FileDataWriter.hppDefinition of the class CDPL::Util::FileDataWriter
 FileFunctions.hppDeclaration of filesystem-related functions
 FileRemover.hppDefinition of the class CDPL::Util::FileRemover
 FileScreeningHitCollector.hppDefinition of the class CDPL::Pharm::FileScreeningHitCollector
 Font.hppDefinition of the class CDPL::Vis::Font
 FontMetrics.hppDefinition of the class CDPL::Vis::FontMetrics
 ForceField.hppA convenience header including everything that is defined in namespace CDPL::ForceField
 ForceFieldType.hppDefinition of constants in namespace CDPL::ConfGen::ForceFieldType
 Fragment.hppDefinition of the class CDPL::Chem::Fragment
 FragmentAssembler.hppDefinition of the class CDPL::ConfGen::FragmentAssembler
 FragmentAssemblerSettings.hppDefinition of the class CDPL::ConfGen::FragmentAssemblerSettings
 FragmentConformerGenerator.hppDefinition of the class CDPL::ConfGen::FragmentConformerGenerator
 FragmentConformerGeneratorSettings.hppDefinition of the class CDPL::ConfGen::FragmentConformerGeneratorSettings
 FragmentFunctions.hppDeclaration of functions that operate on Chem::Fragment instances
 FragmentGenerator.hppDefinition of the class CDPL::Chem::FragmentGenerator
 FragmentLibrary.hppDefinition of the class CDPL::ConfGen::FragmentLibrary
 FragmentLibraryEntry.hppDefinition of the class CDPL::ConfGen::FragmentLibraryEntry
 FragmentLibraryGenerator.hppDefinition of the class CDPL::ConfGen::FragmentLibraryGenerator
 FragmentList.hppDefinition of the class CDPL::Chem::FragmentList
 FragmentType.hppDefinition of constants in namespace CDPL::ConfGen::FragmentType
 Functional.hppDefinition of various functors
 GaussianShape.hppDefinition of the class CDPL::Shape::GaussianShape
 GaussianShapeAlignment.hppDefinition of the class CDPL::Shape::GaussianShapeAlignment
 GaussianShapeAlignmentStartGenerator.hppDefinition of the class CDPL::Shape::GaussianShapeAlignmentStartGenerator
 GaussianShapeFunction.hppDefinition of the class CDPL::Shape::GaussianShapeFunction
 GaussianShapeFunctionAlignment.hppDefinition of the class CDPL::Shape::GaussianShapeFunctionAlignment
 GaussianShapeFunctions.hppDeclaration of functions operating on object of type Shape::GaussianShape
 GaussianShapeGenerator.hppDefinition of the class CDPL::Shape::GaussianShapeGenerator
 GaussianShapeOverlapFunction.hppDefinition of the class CDPL::Shape::GaussianShapeOverlapFunction
 GaussianShapeSet.hppDefinition of the class CDPL::Shape::GaussianShapeSet
 GeneralizedBellAtomDensity.hppDefinition of the class CDPL::GRAIL::GeneralizedBellAtomDensity
 GenericHydrogen13ShiftTautomerization.hppDefinition of the class CDPL::Chem::GenericHydrogen13ShiftTautomerization
 GenericHydrogen15ShiftTautomerization.hppDefinition of the class CDPL::Chem::GenericHydrogen15ShiftTautomerization
 GradientVectorTraits.hppDefinition of the class CDPL::ForceField::GradientVectorTraits
 GRAIL.hppA convenience header including everything that is defined in namespace CDPL::GRAIL
 GRAILDataSetGenerator.hppDefinition of the class CDPL::GRAIL::GRAILDataSetGenerator
 GRAILDescriptorCalculator.hppDefinition of the class CDPL::GRAIL::GRAILDescriptorCalculator
 GRAILXDescriptorCalculator.hppDefinition of the class CDPL::GRAIL::GRAILXDescriptorCalculator
 GraphicsPrimitive2D.hppDefinition of the class CDPL::Vis::GraphicsPrimitive2D
 Grid.hppA convenience header including everything that is defined in namespace CDPL::Grid
 Math/Grid.hppDefinition of grid data types
 GridAssignment.hppImplementation of grid assignment routines
 GridExpression.hppDefinition of various grid expression types and operations
 HashCodeCalculator.hppDefinition of the class CDPL::Chem::HashCodeCalculator
 HBondAcceptorAtomType.hppDefinition of constants in namespace CDPL::MolProp::HBondAcceptorAtomType
 HBondAcceptorAtomTyper.hppDefinition of the class CDPL::MolProp::HBondAcceptorAtomTyper
 HBondAcceptorFeatureGenerator.hppDefinition of the class CDPL::Pharm::HBondAcceptorFeatureGenerator
 HBondDonorAtomType.hppDefinition of constants in namespace CDPL::MolProp::HBondDonorAtomType
 HBondDonorAtomTyper.hppDefinition of the class CDPL::MolProp::HBondDonorAtomTyper
 HBondDonorFeatureGenerator.hppDefinition of the class CDPL::Pharm::HBondDonorFeatureGenerator
 HBondingInteractionConstraint.hppDefinition of the class CDPL::Pharm::HBondingInteractionConstraint
 HBondingInteractionScore.hppDefinition of the class CDPL::Pharm::HBondingInteractionScore
 HierarchyView.hppDefinition of the class CDPL::Biomol::HierarchyView
 HierarchyViewChain.hppDefinition of the class CDPL::Biomol::HierarchyViewChain
 HierarchyViewFragment.hppDefinition of the class CDPL::Biomol::HierarchyViewFragment
 HierarchyViewModel.hppDefinition of the class CDPL::Biomol::HierarchyViewModel
 HierarchyViewNode.hppDefinition of the class CDPL::Biomol::HierarchyViewNode
 HybridizationState.hppDefinition of constants in namespace CDPL::Chem::HybridizationState
 Hydrogen3DCoordinatesCalculator.hppDefinition of the class CDPL::Chem::Hydrogen3DCoordinatesCalculator
 HydrophobicAtomFeatureGenerator.hppDefinition of the class CDPL::Pharm::HydrophobicAtomFeatureGenerator
 HydrophobicFeatureGenerator.hppDefinition of the class CDPL::Pharm::HydrophobicFeatureGenerator
 HydrophobicInteractionConstraint.hppDefinition of the class CDPL::Pharm::HydrophobicInteractionConstraint
 HydrophobicInteractionScore.hppDefinition of the class CDPL::Pharm::HydrophobicInteractionScore
 ImageWriter.hpp
 ImineEnamineTautomerization.hppDefinition of the class CDPL::Chem::ImineEnamineTautomerization
 INCHIMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::INCHIMolecularGraphOutputHandler
 INCHIMolecularGraphWriter.hppDefinition of the class CDPL::Chem::INCHIMolecularGraphWriter
 INCHIMoleculeInputHandler.hppDefinition of the class CDPL::Chem::INCHIMoleculeInputHandler
 INCHIMoleculeReader.hppDefinition of the class CDPL::Chem::INCHIMoleculeReader
 INCHIReturnCode.hppDefinition of constants in namespace CDPL::Chem::INCHIReturnCode
 IndexedElementIterator.hppDefinition of the class CDPL::Util::IndexedElementIterator
 IndirectArray.hppDefinition of the class CDPL::Util::IndirectArray
 InteractionAnalyzer.hppDefinition of the class CDPL::Pharm::InteractionAnalyzer
 InteractionConstraintConnector.hppDefinition of the class CDPL::Pharm::InteractionConstraintConnector
 InteractionFilterFunctions.hppType definition of generic wrapper classes for storing user-defined interaction filtering functions
 InteractionPharmacophoreGenerator.hppDefinition of the class CDPL::Pharm::InteractionPharmacophoreGenerator
 InteractionType.hppDefinition of constants in namespace CDPL::ForceField::InteractionType
 IO.hppStream output operators
 IonicInteractionConstraint.hppDefinition of the class CDPL::Pharm::IonicInteractionConstraint
 IonicInteractionScore.hppDefinition of the class CDPL::Pharm::IonicInteractionScore
 JacobiDiagonalization.hppImplementation of the Jacobi method for the calculation of eigenvalues and eigenvectors
 JMEMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::JMEMolecularGraphOutputHandler
 JMEMolecularGraphWriter.hppDefinition of the class CDPL::Chem::JMEMolecularGraphWriter
 JMEMoleculeInputHandler.hppDefinition of the class CDPL::Chem::JMEMoleculeInputHandler
 JMEMoleculeReader.hppDefinition of the class CDPL::Chem::JMEMoleculeReader
 JMEReactionInputHandler.hppDefinition of the class CDPL::Chem::JMEReactionInputHandler
 JMEReactionOutputHandler.hppDefinition of the class CDPL::Chem::JMEReactionOutputHandler
 JMEReactionReader.hppDefinition of the class CDPL::Chem::JMEReactionReader
 JMEReactionWriter.hppDefinition of the class CDPL::Chem::JMEReactionWriter
 KabschAlgorithm.hppImplementation of the Kabsch algorithm
 KekuleStructureCalculator.hppDefinition of the class CDPL::Chem::KekuleStructureCalculator
 KeteneYnolTautomerization.hppDefinition of the class CDPL::Chem::KeteneYnolTautomerization
 KetoEnolTautomerization.hppDefinition of the class CDPL::Chem::KetoEnolTautomerization
 LactamLactimTautomerization.hppDefinition of the class CDPL::Chem::LactamLactimTautomerization
 LayoutDirection.hppDefinition of constants in namespace CDPL::Vis::LayoutDirection
 LayoutStyle.hppDefinition of constants in namespace CDPL::Vis::LayoutStyle
 Line2D.hppDefinition of the class CDPL::Vis::Line2D
 LinearSolve.hppFunctions for solving linear equations
 LinePrimitive2D.hppDefinition of the class CDPL::Vis::LinePrimitive2D
 LineSegmentListPrimitive2D.hppDefinition of the class CDPL::Vis::LineSegmentListPrimitive2D
 LogMessageCallbackFunction.hppType definition of a generic wrapper class for storing user-defined log message callback functions
 LogSCalculator.hppDefinition of the class CDPL::MolProp::LogSCalculator
 LookupKey.hppDefinition of the class CDPL::Base::LookupKey
 LookupKeyDefinition.hppDefinition of the preprocessor macro CDPL_DEFINE_LOOKUP_KEY
 LUDecomposition.hppImplementation of matrix LU-decomposition and associated operations
 Map.hppDefinition of the class CDPL::Util::Map
 MassComposition.hppDefinition of the type CDPL::MolProp::MassComposition
 MatchConstraintList.hppDefinition of the class CDPL::Chem::MatchConstraintList
 MatchExpression.hppDefinition of the class CDPL::Chem::MatchExpression
 MatchExpressionList.hppDefinition of the class CDPL::Chem::MatchExpressionList
 Math.hppA convenience header including everything that is defined in namespace CDPL::Math
 Matrix.hppDefinition of matrix data types
 MatrixAdapter.hppProvides matrix adapter classes
 MatrixAssignment.hppImplementation of matrix assignment routines
 MatrixExpression.hppDefinition of various matrix expression types and operations
 MatrixProxy.hppDefinition of matrix proxy types
 MaxCommonAtomSubstructureSearch.hppDefinition of the class CDPL::Chem::MaxCommonAtomSubstructureSearch
 MaxCommonBondSubstructureSearch.hppDefinition of the class CDPL::Chem::MaxCommonBondSubstructureSearch
 MDLDataFormatVersion.hppDefinition of constants in namespace CDPL::Chem::MDLDataFormatVersion
 MDLParity.hppDefinition of constants in namespace CDPL::Chem::MDLParity
 MHMOPiChargeCalculator.hppDefinition of the class CDPL::MolProp::MHMOPiChargeCalculator
 MinimizerVariableArrayTraits.hppProvides traits to flexibly handle different types of variable arrays in function optimization algorithms
 MLRModel.hppDefinition of the class CDPL::Math::MLRModel
 MMFF94AngleBendingInteraction.hppDefinition of the class CDPL::ForceField::MMFF94AngleBendingInteraction
 MMFF94AngleBendingInteractionList.hppDefinition of the class CDPL::ForceField::MMFF94AngleBendingInteractionList
 MMFF94AngleBendingInteractionParameterizer.hppDefinition of the class CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
 MMFF94AngleBendingParameterTable.hppDefinition of the class CDPL::ForceField::MMFF94AngleBendingParameterTable
 MMFF94AromaticAtomTypeDefinitionTable.hppDefinition of the class CDPL::ForceField::MMFF94AromaticAtomTypeDefinitionTable
 MMFF94AromaticSSSRSubset.hppDefinition of the class CDPL::ForceField::MMFF94AromaticSSSRSubset
 MMFF94AtomTypePropertyTable.hppDefinition of the class CDPL::ForceField::MMFF94AtomTypePropertyTable
 MMFF94AtomTyper.hppDefinition of the class CDPL::ForceField::MMFF94AtomTyper
 MMFF94BondChargeIncrementTable.hppDefinition of the class CDPL::ForceField::MMFF94BondChargeIncrementTable
 MMFF94BondStretchingInteraction.hppDefinition of the class CDPL::ForceField::MMFF94BondStretchingInteraction
 MMFF94BondStretchingInteractionList.hppDefinition of the class CDPL::ForceField::MMFF94BondStretchingInteractionList
 MMFF94BondStretchingInteractionParameterizer.hppDefinition of the class CDPL::ForceField::MMFF94BondStretchingInteractionParameterizer
 MMFF94BondStretchingParameterTable.hppDefinition of the class CDPL::ForceField::MMFF94BondStretchingParameterTable
 MMFF94BondStretchingRuleParameterTable.hppDefinition of the class CDPL::ForceField::MMFF94BondStretchingRuleParameterTable
 MMFF94BondTyper.hppDefinition of the class CDPL::ForceField::MMFF94BondTyper
 MMFF94ChargeCalculator.hppDefinition of the class CDPL::ForceField::MMFF94ChargeCalculator
 MMFF94DefaultStretchBendParameterTable.hppDefinition of the class CDPL::ForceField::MMFF94DefaultStretchBendParameterTable
 MMFF94ElectrostaticInteraction.hppDefinition of the class CDPL::ForceField::MMFF94ElectrostaticInteraction
 MMFF94ElectrostaticInteractionList.hppDefinition of the class CDPL::ForceField::MMFF94ElectrostaticInteractionList
 MMFF94ElectrostaticInteractionParameterizer.hppDefinition of the class CDPL::ForceField::MMFF94ElectrostaticInteractionParameterizer
 MMFF94EnergyCalculator.hppDefinition of the class CDPL::ForceField::MMFF94EnergyCalculator
 MMFF94EnergyFunctions.hppFunctions for the calculation of MMFF94 interaction energies
 MMFF94FormalAtomChargeDefinitionTable.hppDefinition of the class CDPL::ForceField::MMFF94FormalAtomChargeDefinitionTable
 MMFF94GradientCalculator.hppDefinition of the class CDPL::ForceField::MMFF94GradientCalculator
 MMFF94GradientFunctions.hppFunctions for the calculation of MMFF94 interaction energy gradients
 MMFF94HeavyToHydrogenAtomTypeMap.hppDefinition of the class CDPL::ForceField::MMFF94HeavyToHydrogenAtomTypeMap
 MMFF94InteractionData.hppDefinition of the class CDPL::ForceField::MMFF94InteractionData
 MMFF94InteractionParameterizer.hppDefinition of the class CDPL::ForceField::MMFF94InteractionParameterizer
 MMFF94OutOfPlaneBendingInteraction.hppDefinition of the class CDPL::ForceField::MMFF94OutOfPlaneBendingInteraction
 MMFF94OutOfPlaneBendingInteractionList.hppDefinition of the class CDPL::ForceField::MMFF94OutOfPlaneBendingInteractionList
 MMFF94OutOfPlaneBendingInteractionParameterizer.hppDefinition of the class CDPL::ForceField::MMFF94OutOfPlaneBendingInteractionParameterizer
 MMFF94OutOfPlaneBendingParameterTable.hppDefinition of the class CDPL::ForceField::MMFF94OutOfPlaneBendingParameterTable
 MMFF94ParameterSet.hppDefinition of constants in namespace CDPL::ForceField::MMFF94ParameterSet
 MMFF94PartialBondChargeIncrementTable.hppDefinition of the class CDPL::ForceField::MMFF94PartialBondChargeIncrementTable
 MMFF94PrimaryToParameterAtomTypeMap.hppDefinition of the class CDPL::ForceField::MMFF94PrimaryToParameterAtomTypeMap
 MMFF94PropertyFunctions.hppType definition of generic wrapper classes for storing user-defined functions for the retrieval of MMFF94 related properties
 MMFF94StretchBendInteraction.hppDefinition of the class CDPL::ForceField::MMFF94StretchBendInteraction
 MMFF94StretchBendInteractionList.hppDefinition of the class CDPL::ForceField::MMFF94StretchBendInteractionList
 MMFF94StretchBendInteractionParameterizer.hppDefinition of the class CDPL::ForceField::MMFF94StretchBendInteractionParameterizer
 MMFF94StretchBendParameterTable.hppDefinition of the class CDPL::ForceField::MMFF94StretchBendParameterTable
 MMFF94SymbolicAtomTypePatternTable.hppPattern of the class CDPL::ForceField::MMFF94SymbolicAtomTypePatternTable
 MMFF94SymbolicToNumericAtomTypeMap.hppDefinition of the class CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap
 MMFF94TorsionInteraction.hppDefinition of the class CDPL::ForceField::MMFF94TorsionInteraction
 MMFF94TorsionInteractionList.hppDefinition of the class CDPL::ForceField::MMFF94TorsionInteractionList
 MMFF94TorsionInteractionParameterizer.hppDefinition of the class CDPL::ForceField::MMFF94TorsionInteractionParameterizer
 MMFF94TorsionParameterTable.hppDefinition of the class CDPL::ForceField::MMFF94TorsionParameterTable
 MMFF94VanDerWaalsInteraction.hppDefinition of the class CDPL::ForceField::MMFF94VanDerWaalsInteraction
 MMFF94VanDerWaalsInteractionList.hppDefinition of the class CDPL::ForceField::MMFF94VanDerWaalsInteractionList
 MMFF94VanDerWaalsInteractionParameterizer.hppDefinition of the class CDPL::ForceField::MMFF94VanDerWaalsInteractionParameterizer
 MMFF94VanDerWaalsParameterTable.hppDefinition of the class CDPL::ForceField::MMFF94VanDerWaalsParameterTable
 MMTFBZ2MolecularGraphOutputHandler.hppDefinition of the class CDPL::Biomol::MMTFBZ2MolecularGraphOutputHandler
 MMTFBZ2MolecularGraphWriter.hppDefinition of the class CDPL::Biomol::MMTFBZ2MolecularGraphWriter
 MMTFBZ2MoleculeInputHandler.hppDefinition of the class CDPL::Biomol::MMTFBZ2MoleculeInputHandler
 MMTFBZ2MoleculeReader.hppDefinition of the class CDPL::Biomol::MMTFBZ2MoleculeReader
 MMTFGZMolecularGraphOutputHandler.hppDefinition of the class CDPL::Biomol::MMTFGZMolecularGraphOutputHandler
 MMTFGZMolecularGraphWriter.hppDefinition of the class CDPL::Biomol::MMTFGZMolecularGraphWriter
 MMTFGZMoleculeInputHandler.hppDefinition of the class CDPL::Biomol::MMTFGZMoleculeInputHandler
 MMTFGZMoleculeReader.hppDefinition of the class CDPL::Biomol::MMTFGZMoleculeReader
 MMTFMolecularGraphOutputHandler.hppDefinition of the class CDPL::Biomol::MMTFMolecularGraphOutputHandler
 MMTFMolecularGraphWriter.hppDefinition of the class CDPL::Biomol::MMTFMolecularGraphWriter
 MMTFMoleculeInputHandler.hppDefinition of the class CDPL::Biomol::MMTFMoleculeInputHandler
 MMTFMoleculeReader.hppDefinition of the class CDPL::Biomol::MMTFMoleculeReader
 MOL2BZ2MolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::MOL2BZ2MolecularGraphOutputHandler
 MOL2BZ2MolecularGraphWriter.hppDefinition of the class CDPL::Chem::MOL2BZ2MolecularGraphWriter
 MOL2BZ2MoleculeInputHandler.hppDefinition of the class CDPL::Chem::MOL2BZ2MoleculeInputHandler
 MOL2BZ2MoleculeReader.hppDefinition of the class CDPL::Chem::MOL2BZ2MoleculeReader
 MOL2ChargeType.hppDefinition of constants in namespace CDPL::Chem::MOL2ChargeType
 MOL2GZMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::MOL2GZMolecularGraphOutputHandler
 MOL2GZMolecularGraphWriter.hppDefinition of the class CDPL::Chem::MOL2GZMolecularGraphWriter
 MOL2GZMoleculeInputHandler.hppDefinition of the class CDPL::Chem::MOL2GZMoleculeInputHandler
 MOL2GZMoleculeReader.hppDefinition of the class CDPL::Chem::MOL2GZMoleculeReader
 MOL2MolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::MOL2MolecularGraphOutputHandler
 MOL2MolecularGraphWriter.hppDefinition of the class CDPL::Chem::MOL2MolecularGraphWriter
 MOL2MoleculeInputHandler.hppDefinition of the class CDPL::Chem::MOL2MoleculeInputHandler
 MOL2MoleculeReader.hppDefinition of the class CDPL::Chem::MOL2MoleculeReader
 MOL2MoleculeType.hppDefinition of constants in namespace CDPL::Chem::MOL2MoleculeType
 MolecularComplexityCalculator.hppDefinition of the class CDPL::Descr::MolecularGraphComplexityCalculator
 MolecularGraph.hppDefinition of the class CDPL::Chem::MolecularGraph
 MolecularGraphComponentGroupingMatchExpression.hppDefinition of the class CDPL::Chem::ComponentGroupingMatchExpression
 Biomol/MolecularGraphFunctions.hppDeclaration of functions that operate on Chem::MolecularGraph instances
 Chem/MolecularGraphFunctions.hppDeclaration of functions that operate on Chem::MolecularGraph instances
 ConfGen/MolecularGraphFunctions.hppDeclaration of functions that operate on Chem::MolecularGraph instances
 Descr/MolecularGraphFunctions.hppDeclaration of functions that operate on Chem::MolecularGraph instances
 ForceField/MolecularGraphFunctions.hppDeclaration of functions that operate on Chem::MolecularGraph instances
 MolProp/MolecularGraphFunctions.hppDeclaration of functions that operate on Chem::MolecularGraph instances
 Vis/MolecularGraphFunctions.hppDeclaration of functions that operate on Chem::MolecularGraph instances
 MolecularGraphMatchConstraint.hppDefinition of constants in namespace CDPL::Chem::MolecularGraphMatchConstraint
 Biomol/MolecularGraphProperty.hppDefinition of constants in namespace CDPL::Biomol::MolecularGraphProperty
 Chem/MolecularGraphProperty.hppDefinition of constants in namespace CDPL::Chem::MolecularGraphProperty
 ForceField/MolecularGraphProperty.hppDefinition of constants in namespace CDPL::ForceField::MolecularGraphProperty
 Vis/MolecularGraphProperty.hppDefinition of constants in namespace CDPL::Vis::MolecularGraphProperty
 Biomol/MolecularGraphPropertyDefault.hppDefinition of constants in namespace CDPL::Biomol::MolecularGraphPropertyDefault
 Chem/MolecularGraphPropertyDefault.hppDefinition of constants in namespace CDPL::Chem::MolecularGraphPropertyDefault
 Vis/MolecularGraphPropertyDefault.hppDefinition of constants in namespace CDPL::Vis::MolecularGraphPropertyDefault
 MolecularGraphWriter.hppDefinition of the class CDPL::Chem::MolecularGraphWriter
 Molecule.hppDefinition of the class CDPL::Chem::Molecule
 MoleculeAutoCorr2DDescriptorCalculator.hppDefinition of the class CDPL::Descr::MoleculeAutoCorr2DDescriptorCalculator
 MoleculeAutoCorr3DDescriptorCalculator.hppDefinition of the class CDPL::Descr::MoleculeAutoCorr3DDescriptorCalculator
 Biomol/MoleculeFunctions.hppDeclaration of functions that operate on Chem::Molecule instances
 Chem/MoleculeFunctions.hppDeclaration of functions that operate on Chem::Molecule instances
 ConfGen/MoleculeFunctions.hppDeclaration of functions that operate on Chem::Molecule instances
 GRAIL/MoleculeFunctions.hppDeclaration of functions that operate on Chem::Molecule instances
 Pharm/MoleculeFunctions.hppDeclaration of functions that operate on Chem::Molecule instances
 MoleculeRDFDescriptorCalculator.hppDefinition of the class CDPL::Descr::MoleculeRDFDescriptorCalculator
 MoleculeReader.hppDefinition of the class CDPL::Chem::MoleculeReader
 MOLMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::MOLMolecularGraphOutputHandler
 MOLMolecularGraphWriter.hppDefinition of the class CDPL::Chem::MOLMolecularGraphWriter
 MOLMoleculeInputHandler.hppDefinition of the class CDPL::Chem::MOLMoleculeInputHandler
 MOLMoleculeReader.hppDefinition of the class CDPL::Chem::MOLMoleculeReader
 MolProp.hppA convenience header including everything that is defined in namespace CDPL::MolProp
 MorganNumberingCalculator.hppDefinition of the class CDPL::Chem::MorganNumberingCalculator
 MultiConfMoleculeInputProcessor.hppDefinition of the class CDPL::Chem::MultiConfMoleculeInputProcessor
 MultiFormatDataReader.hppDefinition of the class CDPL::Util::MultiFormatDataReader
 MultiFormatDataWriter.hppDefinition of the class CDPL::Util::MultiFormatDataWriter
 MultiMap.hppDefinition of the class CDPL::Util::MultiMap
 NegIonizableFeatureGenerator.hppDefinition of the class CDPL::Pharm::NegIonizableFeatureGenerator
 NitroAciTautomerization.hppDefinition of the class CDPL::Chem::NitroAciTautomerization
 NitrogenEnumerationMode.hppDefinition of constants in namespace CDPL::Confgen::NitrogenEnumerationMode
 NitrosoOximeTautomerization.hppDefinition of the class CDPL::Chem::NitrosoOximeTautomerization
 NOTMatchExpression.hppDefinition of the class CDPL::Chem::NOTMatchExpression
 ObjectPool.hppDefinition of the class CDPL::Util::ObjectPool
 ObjectStack.hppDefinition of the class CDPL::Util::ObjectStack
 ORMatchExpressionList.hppDefinition of the class CDPL::Chem::ORMatchExpressionList
 OrthogonalPiPiInteractionConstraint.hppDefinition of the class CDPL::Pharm::OrthogonalPiPiInteractionConstraint
 OrthogonalPiPiInteractionScore.hppDefinition of the class CDPL::Pharm::OrthogonalPiPiInteractionScore
 ParallelPiPiInteractionConstraint.hppDefinition of the class CDPL::Pharm::ParallelPiPiInteractionConstraint
 ParallelPiPiInteractionScore.hppDefinition of the class CDPL::Pharm::ParallelPiPiInteractionScore
 Path2D.hppDefinition of the class CDPL::Vis::Path2D
 Path2DConverter.hppDefinition of the class CDPL::Vis::Path2DConverter
 PathFingerprintGenerator.hppDefinition of the class CDPL::Descr::PathFingerprintGenerator
 PathPrimitive2D.hppDefinition of the class CDPL::Vis::PathPrimitive2D
 PatternAtomTyper.hppDefinition of the class CDPL::Chem::PatternAtomTyper
 PatternBasedFeatureGenerator.hppDefinition of the class CDPL::Pharm::PatternBasedFeatureGenerator
 PatternBasedTautomerizationRule.hppDefinition of the class CDPL::Chem::PatternBasedTautomerizationRule
 PDBBZ2MolecularGraphOutputHandler.hppDefinition of the class CDPL::Biomol::PDBBZ2MolecularGraphOutputHandler
 PDBBZ2MolecularGraphWriter.hppDefinition of the class CDPL::Biomol::PDBBZ2MolecularGraphWriter
 PDBBZ2MoleculeInputHandler.hppDefinition of the class CDPL::Biomol::PDBBZ2MoleculeInputHandler
 PDBBZ2MoleculeReader.hppDefinition of the class CDPL::Biomol::PDBBZ2MoleculeReader
 PDBData.hppDefinition of the class CDPL::Biomol::PDBData
 PDBFormatVersion.hppDefinition of constants in namespace CDPL::Biomol::PDBFormatVersion
 PDBGZMolecularGraphOutputHandler.hppDefinition of the class CDPL::Biomol::PDBGZMolecularGraphOutputHandler
 PDBGZMolecularGraphWriter.hppDefinition of the class CDPL::Biomol::PDBGZMolecularGraphWriter
 PDBGZMoleculeInputHandler.hppDefinition of the class CDPL::Biomol::PDBGZMoleculeInputHandler
 PDBGZMoleculeReader.hppDefinition of the class CDPL::Biomol::PDBGZMoleculeReader
 PDBMolecularGraphOutputHandler.hppDefinition of the class CDPL::Biomol::PDBMolecularGraphOutputHandler
 PDBMolecularGraphWriter.hppDefinition of the class CDPL::Biomol::PDBMolecularGraphWriter
 PDBMoleculeInputHandler.hppDefinition of the class CDPL::Biomol::PDBMoleculeInputHandler
 PDBMoleculeReader.hppDefinition of the class CDPL::Biomol::PDBMoleculeReader
 PDFMolecularGraphOutputHandler.hppDefinition of the class CDPL::Vis::PDFMolecularGraphOutputHandler
 PDFMolecularGraphWriter.hppDefinition of the class CDPL::Vis::PDFMolecularGraphWriter
 PDFReactionOutputHandler.hppDefinition of the class CDPL::Vis::PDFReactionOutputHandler
 PDFReactionWriter.hppDefinition of the class CDPL::Vis::PDFReactionWriter
 Pen.hppDefinition of the class CDPL::Vis::Pen
 PEOESigmaChargeCalculator.hppDefinition of the class CDPL::MolProp::PEOESigmaChargeCalculator
 Pharm.hppA convenience header including everything that is defined in namespace CDPL::Pharm
 Pharmacophore.hppDefinition of the class CDPL::Pharm::Pharmacophore
 PharmacophoreAlignment.hppDefinition of the class CDPL::Pharm::PharmacophoreAlignment
 PharmacophoreAutoCorr3DDescriptorCalculator.hppDefinition of the class CDPL::Descr::PharmacophoreAutoCorr3DDescriptorCalculator
 PharmacophoreFitScore.hppDefinition of the class CDPL::Pharm::PharmacophoreFitScore
 PharmacophoreFitScreeningScore.hppDefinition of the class CDPL::Pharm::PharmacophoreFitScreeningScore
 PharmacophoreFunctions.hppDeclaration of functions that operate on Pharm::Pharmacophore instances
 PharmacophoreGenerator.hppDefinition of the class CDPL::Pharm::PharmacophoreGenerator
 PharmacophoreRDFDescriptorCalculator.hppDefinition of the class CDPL::Descr::PharmacophoreRDFDescriptorCalculator
 PharmacophoreReader.hppDefinition of the class CDPL::Pharm::PharmacophoreReader
 PhosphinicAcidTautomerization.hppDefinition of the class CDPL::Chem::PhosphinicAcidTautomerization
 PiElectronSystemList.hppDefinition of the class CDPL::Chem::PiElectronSystemList
 PMLFeatureContainerOutputHandler.hppDefinition of the class CDPL::Pharm::PMLFeatureContainerOutputHandler
 PMLFeatureContainerWriter.hppDefinition of the class CDPL::Pharm::PMLFeatureContainerWriter
 PMLPharmacophoreInputHandler.hppDefinition of the class CDPL::Pharm::PMLPharmacophoreInputHandler
 PMLPharmacophoreReader.hppDefinition of the class CDPL::Pharm::PMLPharmacophoreReader
 PNGMolecularGraphOutputHandler.hppDefinition of the class CDPL::Vis::PNGMolecularGraphOutputHandler
 PNGMolecularGraphWriter.hppDefinition of the class CDPL::Vis::PNGMolecularGraphWriter
 PNGReactionOutputHandler.hppDefinition of the class CDPL::Vis::PNGReactionOutputHandler
 PNGReactionWriter.hppDefinition of the class CDPL::Vis::PNGReactionWriter
 PointArray2D.hppDefinition of the class CDPL::Vis::PointArray2D
 PointListPrimitive2D.hppDefinition of the class CDPL::Vis::PointListPrimitive2D
 PolygonPrimitive2D.hppDefinition of the class CDPL::Vis::PolygonPrimitive2D
 PolylinePrimitive2D.hppDefinition of the class CDPL::Vis::PolylinePrimitive2D
 PosIonizableFeatureGenerator.hppDefinition of the class CDPL::Pharm::PosIonizableFeatureGenerator
 PrincipalAxesAlignmentStartGenerator.hppDefinition of the class CDPL::Shape::PrincipalAxesAlignmentStartGenerator
 ProcessingFlags.hppDefinition of flags for serial and residue sequence number processing
 PropertyContainer.hppDefinition of the class CDPL::Base::PropertyContainer
 PropertyMatchExpression.hppDefinition of the class CDPL::Chem::PropertyMatchExpression
 PropertyValue.hppDefinition of the class CDPL::Util::PropertyValue
 PropertyValueProduct.hppDefinition of the class CDPL::Util::PropertyValueProduct
 ProtonationStateStandardizer.hppDefinition of the class CDPL::Chem::ProtonationStateStandardizer
 PSDMolecularGraphOutputHandler.hppDefinition of the class CDPL::Pharm::PSDMolecularGraphOutputHandler
 PSDMolecularGraphWriter.hppDefinition of the class CDPL::Pharm::PSDMolecularGraphWriter
 PSDMoleculeInputHandler.hppDefinition of the class CDPL::Pharm::PSDMoleculeInputHandler
 PSDMoleculeReader.hppDefinition of the class CDPL::Pharm::PSDMoleculeReader
 PSDPharmacophoreInputHandler.hppDefinition of the class CDPL::Pharm::PSDPharmacophoreInputHandler
 PSDPharmacophoreReader.hppDefinition of the class CDPL::Pharm::PSDPharmacophoreReader
 PSDScreeningDBAccessor.hppDefinition of the class CDPL::Pharm::PSDScreeningDBAccessor
 PSDScreeningDBCreator.hppDefinition of the class CDPL::Pharm::PSDScreeningDBCreator
 PSMolecularGraphOutputHandler.hppDefinition of the class CDPL::Vis::PSMolecularGraphOutputHandler
 PSMolecularGraphWriter.hppDefinition of the class CDPL::Vis::PSMolecularGraphWriter
 PSReactionOutputHandler.hppDefinition of the class CDPL::Vis::PSReactionOutputHandler
 PSReactionWriter.hppDefinition of the class CDPL::Vis::PSReactionWriter
 QtFontMetrics.hppDefinition of the class CDPL::Vis::QtFontMetrics
 QtObjectFactory.hppDefinition of the class CDPL::Vis::QtObjectFactory
 QtRenderer2D.hppDefinition of the class CDPL::Vis::QtRenderer2D
 Quaternion.hppDefinition of quaternion data types
 QuaternionAdapter.hppProvides quaternion adapter classes
 QuaternionAssignment.hppImplementation of quaternion assignment routines
 QuaternionExpression.hppDefinition of various quaternion expression types and operations
 QuaternionTransformation.hppDefinition of the type CDPL::Shape::QuaternionTransformation
 RadicalType.hppDefinition of constants in namespace CDPL::Chem::RadicalType
 Range.hppDefinition of a data type for describing index ranges
 RDFBZ2ReactionInputHandler.hppDefinition of the class CDPL::Chem::RDFBZ2ReactionInputHandler
 RDFBZ2ReactionOutputHandler.hppDefinition of the class CDPL::Chem::RDFBZ2ReactionOutputHandler
 RDFBZ2ReactionReader.hppDefinition of the class CDPL::Chem::RDFBZ2ReactionReader
 RDFBZ2ReactionWriter.hppDefinition of the class CDPL::Chem::RDFBZ2ReactionWriter
 RDFCodeCalculator.hppDefinition of the class CDPL::Descr::RDFCodeCalculator
 RDFGZReactionInputHandler.hppDefinition of the class CDPL::Chem::RDFGZReactionInputHandler
 RDFGZReactionOutputHandler.hppDefinition of the class CDPL::Chem::RDFGZReactionOutputHandler
 RDFGZReactionReader.hppDefinition of the class CDPL::Chem::RDFGZReactionReader
 RDFGZReactionWriter.hppDefinition of the class CDPL::Chem::RDFGZReactionWriter
 RDFReactionInputHandler.hppDefinition of the class CDPL::Chem::RDFReactionInputHandler
 RDFReactionOutputHandler.hppDefinition of the class CDPL::Chem::RDFReactionOutputHandler
 RDFReactionReader.hppDefinition of the class CDPL::Chem::RDFReactionReader
 RDFReactionWriter.hppDefinition of the class CDPL::Chem::RDFReactionWriter
 Reaction.hppDefinition of the class CDPL::Chem::Reaction
 ReactionAtomMappingMatchExpression.hppDefinition of the class CDPL::Chem::ReactionAtomMappingMatchExpression
 ReactionCenterStatus.hppDefinition of constants in namespace CDPL::Chem::ReactionCenterStatus
 ReactionComponentGroupingMatchExpression.hppDefinition of the class CDPL::Chem::ReactionComponentGroupingMatchExpression
 Chem/ReactionFunctions.hppDeclaration of functions that operate on Chem::Reaction instances
 Vis/ReactionFunctions.hppDeclaration of functions that operate on Chem::Reaction instances
 ReactionMatchConstraint.hppDefinition of constants in namespace CDPL::Chem::ReactionMatchConstraint
 Chem/ReactionProperty.hppDefinition of constants in namespace CDPL::Chem::ReactionProperty
 Vis/ReactionProperty.hppDefinition of constants in namespace CDPL::Vis::ReactionProperty
 Chem/ReactionPropertyDefault.hppDefinition of constants in namespace CDPL::Chem::ReactionPropertyDefault
 Vis/ReactionPropertyDefault.hppDefinition of constants in namespace CDPL::Chem::ReactionPropertyDefault
 ReactionReader.hppDefinition of the class CDPL::Chem::ReactionReader
 ReactionRole.hppDefinition of constants in namespace CDPL::Chem::ReactionRole
 ReactionSubstructureSearch.hppDefinition of the class CDPL::Chem::ReactionSubstructureSearch
 ReactionView2D.hppDefinition of the class CDPL::Vis::ReactionView2D
 ReactionWriter.hppDefinition of the class CDPL::Chem::ReactionWriter
 Reactor.hppDefinition of the class CDPL::Chem::Reactor
 RECAPAtomLabel.hppDefinition of constants in namespace CDPL::Chem::RECAPAtomLabel
 RECAPFragmentGenerator.hppDefinition of the class CDPL::Chem::RECAPFragmentGenerator
 RECAPRuleID.hppDefinition of constants in namespace CDPL::Chem::RECAPRuleID
 Rectangle2D.hppDefinition of the class CDPL::Vis::Rectangle2D
 RegularGrid.hppDefinition of a regular spatial grid data type
 RegularGridSet.hppDefinition of the class CDPL::Grid::RegularGridSet
 RegularSpatialGrid.hppDefinition of a regular spatial grid data type
 Renderer2D.hppDefinition of the class CDPL::Vis::Renderer2D
 ResidueDictionary.hppDefinition of the class CDPL::Biomol::ResidueDictionary
 ResidueList.hppDefinition of the class CDPL::Biomol::ResidueList
 ResidueType.hppDefinition of constants in namespace CDPL::Biomol::ResidueType
 ResonanceStructureGenerator.hppDefinition of the class CDPL::Chem::ResonanceStructureGenerator
 ReturnCode.hppDefinition of constants in namespace CDPL::Confgen::ReturnCode
 RMSDConformerSelector.hppDefinition of the class CDPL::ConfGen::RMSDConformerSelector
 RXNReactionInputHandler.hppDefinition of the class CDPL::Chem::RXNReactionInputHandler
 RXNReactionOutputHandler.hppDefinition of the class CDPL::Chem::RXNReactionOutputHandler
 RXNReactionReader.hppDefinition of the class CDPL::Chem::RXNReactionReader
 RXNReactionWriter.hppDefinition of the class CDPL::Chem::RXNReactionWriter
 ScoringFunctions.hppDefinition of shape alignment scoring functions
 ScoringFunctors.hppDefinition of shape alignment scoring functors
 ScreeningDBAccessor.hppDefinition of the class CDPL::Pharm::ScreeningDBAccessor
 ScreeningDBCreator.hppDefinition of the class CDPL::Pharm::ScreeningDBCreator
 Pharm/ScreeningProcessor.hppDefinition of the class CDPL::Pharm::ScreeningProcessor
 Shape/ScreeningProcessor.hppDefinition of the class CDPL::Shape::ScreeningProcessor
 ScreeningSettings.hppDefinition of the class CDPL::Shape::ScreeningSettings
 SDFBZ2MolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::SDFBZ2MolecularGraphOutputHandler
 SDFBZ2MolecularGraphWriter.hppDefinition of the class CDPL::Chem::SDFBZ2MolecularGraphWriter
 SDFBZ2MoleculeInputHandler.hppDefinition of the class CDPL::Chem::SDFBZ2MoleculeInputHandler
 SDFBZ2MoleculeReader.hppDefinition of the class CDPL::Chem::SDFBZ2MoleculeReader
 SDFGZMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::SDFGZMolecularGraphOutputHandler
 SDFGZMolecularGraphWriter.hppDefinition of the class CDPL::Chem::SDFGZMolecularGraphWriter
 SDFGZMoleculeInputHandler.hppDefinition of the class CDPL::Chem::SDFGZMoleculeInputHandler
 SDFGZMoleculeReader.hppDefinition of the class CDPL::Chem::SDFGZMoleculeReader
 SDFMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::SDFMolecularGraphOutputHandler
 SDFMolecularGraphWriter.hppDefinition of the class CDPL::Chem::SDFMolecularGraphWriter
 SDFMoleculeInputHandler.hppDefinition of the class CDPL::Chem::SDFMoleculeInputHandler
 SDFMoleculeReader.hppDefinition of the class CDPL::Chem::SDFMoleculeReader
 SequenceFunctions.hppUtility functions for sequential processing
 Shape.hppA convenience header including everything that is defined in namespace CDPL::Shape
 SimilarityFunctions.hppProvides functions for the calculation of various similarity measures
 SizeAdjustment.hppProvides the contents of namespace CDPL::Vis::SizeAdjustment
 SizeSpecification.hppDefinition of the class CDPL::Vis::SizeSpecification
 Slice.hppDefinition of a data type for describing index slices
 SmallestSetOfSmallestRings.hppDefinition of the class CDPL::Chem::SmallestSetOfSmallestRings
 SMARTSMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::SMARTSMolecularGraphOutputHandler
 SMARTSMolecularGraphWriter.hppDefinition of the class CDPL::Chem::SMARTSMolecularGraphWriter
 SMARTSMoleculeInputHandler.hppDefinition of the class CDPL::Chem::SMARTSMoleculeInputHandler
 SMARTSMoleculeReader.hppDefinition of the class CDPL::Chem::SMARTSMoleculeReader
 SMARTSReactionInputHandler.hppDefinition of the class CDPL::Chem::SMARTSReactionInputHandler
 SMARTSReactionOutputHandler.hppDefinition of the class CDPL::Chem::SMARTSReactionOutputHandler
 SMARTSReactionReader.hppDefinition of the class CDPL::Chem::SMARTSReactionReader
 SMARTSReactionWriter.hppDefinition of the class CDPL::Chem::SMARTSReactionWriter
 SMILESBZ2MolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::SMILESBZ2MolecularGraphOutputHandler
 SMILESBZ2MolecularGraphWriter.hppDefinition of the class CDPL::Chem::SMILESBZ2MolecularGraphWriter
 SMILESBZ2MoleculeInputHandler.hppDefinition of the class CDPL::Chem::SMILESBZ2MoleculeInputHandler
 SMILESBZ2MoleculeReader.hppDefinition of the class CDPL::Chem::SMILESBZ2MoleculeReader
 SMILESBZ2ReactionInputHandler.hppDefinition of the class CDPL::Chem::SMILESBZ2ReactionInputHandler
 SMILESBZ2ReactionOutputHandler.hppDefinition of the class CDPL::Chem::SMILESBZ2ReactionOutputHandler
 SMILESBZ2ReactionReader.hppDefinition of the class CDPL::Chem::SMILESBZ2ReactionReader
 SMILESBZ2ReactionWriter.hppDefinition of the class CDPL::Chem::SMILESBZ2ReactionWriter
 SMILESGZMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::SMILESGZMolecularGraphOutputHandler
 SMILESGZMolecularGraphWriter.hppDefinition of the class CDPL::Chem::SMILESGZMolecularGraphWriter
 SMILESGZMoleculeInputHandler.hppDefinition of the class CDPL::Chem::SMILESGZMoleculeInputHandler
 SMILESGZMoleculeReader.hppDefinition of the class CDPL::Chem::SMILESGZMoleculeReader
 SMILESGZReactionInputHandler.hppDefinition of the class CDPL::Chem::SMILESGZReactionInputHandler
 SMILESGZReactionOutputHandler.hppDefinition of the class CDPL::Chem::SMILESGZReactionOutputHandler
 SMILESGZReactionReader.hppDefinition of the class CDPL::Chem::SMILESGZReactionReader
 SMILESGZReactionWriter.hppDefinition of the class CDPL::Chem::SMILESGZReactionWriter
 SMILESMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::SMILESMolecularGraphOutputHandler
 SMILESMolecularGraphWriter.hppDefinition of the class CDPL::Chem::SMILESMolecularGraphWriter
 SMILESMoleculeInputHandler.hppDefinition of the class CDPL::Chem::SMILESMoleculeInputHandler
 SMILESMoleculeReader.hppDefinition of the class CDPL::Chem::SMILESMoleculeReader
 SMILESReactionInputHandler.hppDefinition of the class CDPL::Chem::SMILESReactionInputHandler
 SMILESReactionOutputHandler.hppDefinition of the class CDPL::Chem::SMILESReactionOutputHandler
 SMILESReactionReader.hppDefinition of the class CDPL::Chem::SMILESReactionReader
 SMILESReactionWriter.hppDefinition of the class CDPL::Chem::SMILESReactionWriter
 SparseContainerElement.hppDefinition of an element proxy for sparse data types
 SpatialEntityAlignment.hppDefinition of the class CDPL::Chem::SpatialEntityAlignment
 SpatialFeatureMapping.hppDefinition of the class CDPL::Pharm::SpatialFeatureMapping
 SpatialGrid.hppDefinition of a spatial grid data type
 SpecialFunctions.hppProvides miscellaneous special mathematical functions
 StereoDescriptor.hppDefinition of the type CDPL::Chem::StereoDescriptor
 StereoisomerGenerator.hppDefinition of the class CDPL::Chem::StereoisomerGenerator
 StreamDataReader.hppDefinition of the class CDPL::Util::StreamDataReader
 StringDataBlock.hppDefinition of the class CDPL::Chem::StringDataBlockItem and the type CDPL::Chem::StringDataBlock
 StructureGenerationMode.hppDefinition of constants in namespace CDPL::ConfGen::StructureGenerationMode
 StructureGenerator.hppDefinition of the class CDPL::ConfGen::StructureGenerator
 StructureGeneratorSettings.hppDefinition of the class CDPL::ConfGen::StructureGeneratorSettings
 StructureView2D.hppDefinition of the class CDPL::Vis::StructureView2D
 SubstructureHistogramCalculator.hppDefinition of the class CDPL::Chem::SubstructureHistogramCalculator
 SubstructureSearch.hppDefinition of the class CDPL::Chem::SubstructureSearch
 SulfenicAcidTautomerization.hppDefinition of the class CDPL::Chem::SulfenicAcidTautomerization
 SurfaceAtomExtractor.hppDefinition of the class CDPL::Chem::SurfaceAtomExtractor
 SVBackSubstitution.hppImplementation of singular value backsubstitution
 SVDecomposition.hppImplementation of matrix singular value decomposition and associated operations
 SVGMolecularGraphOutputHandler.hppDefinition of the class CDPL::Vis::SVGMolecularGraphOutputHandler
 SVGMolecularGraphWriter.hppDefinition of the class CDPL::Vis::SVGMolecularGraphWriter
 SVGReactionOutputHandler.hppDefinition of the class CDPL::Vis::SVGReactionOutputHandler
 SVGReactionWriter.hppDefinition of the class CDPL::Vis::SVGReactionWriter
 SybylAtomType.hppDefinition of constants in namespace CDPL::Chem::SybylAtomType
 SybylBondType.hppDefinition of constants in namespace CDPL::Chem::SybylBondType
 SymmetryClass.hppDefinition of constants in namespace CDPL::Shape::SymmetryClass
 SymmetryClassCalculator.hppDefinition of the class CDPL::Chem::SymmetryClassCalculator
 TautomerGenerator.hppDefinition of the class CDPL::Chem::TautomerGenerator
 TautomerizationRule.hppDefinition of the class CDPL::Chem::TautomerizationRule
 TautomerizationType.hppDefinition of constants in namespace CDPL::Chem::TautomerizationType
 TautomerScore.hppDefinition of the class CDPL::Chem::TautomerScore
 TextLabelPrimitive2D.hppDefinition of the class CDPL::Vis::TextLabelPrimitive2D
 TopologicalAtomDistanceFunction.hppType definition of generic wrapper class for storing an user-defined topological atom-pair distance function
 TopologicalEntityAlignment.hppDefinition of the class CDPL::Chem::TopologicalEntityAlignment
 TorsionCategory.hppDefinition of the class CDPL::ConfGen::TorsionCategory
 TorsionDriver.hppDefinition of the class CDPL::ConfGen::TorsionDriver
 TorsionDriverSettings.hppDefinition of the class CDPL::ConfGen::TorsionDriverSettings
 TorsionLibrary.hppDefinition of the class CDPL::ConfGen::TorsionLibrary
 TorsionRule.hppDefinition of the class CDPL::ConfGen::TorsionRule
 TorsionRuleMatch.hppDefinition of the class CDPL::ConfGen::TorsionRuleMatch
 TorsionRuleMatcher.hppDefinition of the class CDPL::ConfGen::TorsionRuleMatcher
 TPSACalculator.hppDefinition of the class CDPL::MolProp::TPSACalculator
 TypeTraits.hppDefinition of type traits
 UFFAtomType.hppDefinition of constants in namespace CDPL::ForceField::UFFAtomType
 UFFAtomTypePropertyTable.hppDefinition of the class CDPL::ForceField::UFFAtomTypePropertyTable
 Util.hppA convenience header including everything that is defined in namespace CDPL::Util
 Biomol/UtilityFunctions.hppDeclaration of various utility functions
 Chem/UtilityFunctions.hppDeclaration of miscellaneous utility functions
 ForceField/UtilityFunctions.hppUtility functions used in the calculation of force field energies and gradients
 Pharm/UtilityFunctions.hppDeclaration of miscellaneous utility functions
 Shape/UtilityFunctions.hppDeclaration of miscellaneous utility functions
 Vector.hppDefinition of vector data types
 VectorAdapter.hppProvides vector adapter classes
 VectorArray.hppDefinition of the class CDPL::Math::VectorArray
 VectorArrayAlignmentCalculator.hppImplementation of the Kabsch algorithm
 VectorArrayFunctions.hppDefinition of utility functions operating on CDPL::Math::VectorArray instances
 VectorAssignment.hppImplementation of vector assignment routines
 VectorExpression.hppDefinition of various vector expression types and operations
 VectorIterator.hppDefinition of vector element iterator traits and functions
 VectorProxy.hppDefinition of vector proxy types
 Version.hppProvides CDPKit version information
 View2D.hppDefinition of the class CDPL::Vis::View2D
 Vis.hppA convenience header including everything that is defined in namespace CDPL::Vis
 XBondAcceptorFeatureGenerator.hppDefinition of the class CDPL::Pharm::XBondAcceptorFeatureGenerator
 XBondDonorFeatureGenerator.hppDefinition of the class CDPL::Pharm::XBondDonorFeatureGenerator
 XBondingInteractionConstraint.hppDefinition of the class CDPL::Pharm::XBondingInteractionConstraint
 XBondingInteractionScore.hppDefinition of the class CDPL::Pharm::XBondingInteractionScore
 XLogPCalculator.hppDefinition of the class CDPL::MolProp::XLogPCalculator
 XYZBZ2MolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::XYZBZ2MolecularGraphOutputHandler
 XYZBZ2MolecularGraphWriter.hppDefinition of the class CDPL::Chem::XYZBZ2MolecularGraphWriter
 XYZBZ2MoleculeInputHandler.hppDefinition of the class CDPL::Chem::XYZBZ2MoleculeInputHandler
 XYZBZ2MoleculeReader.hppDefinition of the class CDPL::Chem::XYZBZ2MoleculeReader
 XYZGZMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::XYZGZMolecularGraphOutputHandler
 XYZGZMolecularGraphWriter.hppDefinition of the class CDPL::Chem::XYZGZMolecularGraphWriter
 XYZGZMoleculeInputHandler.hppDefinition of the class CDPL::Chem::XYZGZMoleculeInputHandler
 XYZGZMoleculeReader.hppDefinition of the class CDPL::Chem::XYZGZMoleculeReader
 XYZMolecularGraphOutputHandler.hppDefinition of the class CDPL::Chem::XYZMolecularGraphOutputHandler
 XYZMolecularGraphWriter.hppDefinition of the class CDPL::Chem::XYZMolecularGraphWriter
 XYZMoleculeInputHandler.hppDefinition of the class CDPL::Chem::XYZMoleculeInputHandler
 XYZMoleculeReader.hppDefinition of the class CDPL::Chem::XYZMoleculeReader