Here is a list of all documented class members with links to
the class documentation for each member:
- Object() : BALL::Object
- OBJECT :
BALL::NamedProperty
- OBJECT_HEADER :
BALL::XDRPersistenceManager
- OBJECT_TRAILER :
BALL::XDRPersistenceManager
- ObjectCreator() :
BALL::ObjectCreator
- OFFSET :
BALL::FDPB::FDPB::Option
- okPressed() :
BALL::VIEW::DockDialog
- old_energy_ :
BALL::EnergyMinimizer
- old_grad_ :
BALL::EnergyMinimizer
- old_gtg_ :
BALL::ConjugateGradientMinimizer
- oneBackwardClicked() :
BALL::VIEW::SnapshotVisualisationDialog
- oneForwardClicked() :
BALL::VIEW::SnapshotVisualisationDialog
- onNotify() :
BALL::VIEW::LabelDialog ,
BALL::VIEW::ModifyRepresentationDialog ,
BALL::VIEW::MolecularFileDialog ,
BALL::VIEW::ConnectionObject ,
BALL::VIEW::MainControl ,
BALL::VIEW::DatasetControl ,
BALL::VIEW::DockingController ,
BALL::VIEW::EditableScene ,
BALL::VIEW::GenericControl ,
BALL::VIEW::GeometricControl ,
BALL::VIEW::HelpViewer ,
BALL::VIEW::MolecularControl ,
BALL::NotificationTarget< NotificationSource > ,
BALL::VIEW::MolecularStructure ,
BALL::VIEW::RegularData1DWidget ,
BALL::VIEW::DisplayProperties ,
BALL::VIEW::RegularData2DWidget ,
BALL::VIEW::Scene
- open() : BALL::DCDFile
,
BALL::DSN6File ,
BALL::MolFileFactory , BALL::File
,
BALL::VIEW::DatasetController
- OpenBruker1DFile() :
BALL::VIEW::OpenBruker1DFile
- OpenBruker2DFile() :
BALL::VIEW::OpenBruker2DFile
- openFile() :
BALL::VIEW::MolecularFileDialog ,
BALL::VIEW::OpenBruker1DFile ,
BALL::VIEW::OpenBruker2DFile ,
BALL::VIEW::MainControl ,
BALL::VIEW::ModularWidget ,
BALL::VIEW::DatasetControl ,
BALL::VIEW::PyWidget ,
BALL::VIEW::TestFramework
- openItems() :
BALL::VIEW::NewSelectionMessage
- OpenMode : BALL::File
- openMolecularFile() :
BALL::VIEW::MolecularFileDialog
- operator BitVector &() :
BALL::PropertyManager
- operator bool() : BALL::Bit
- operator char() :
BALL::VIEW::ColorUnit
- operator const Position &() :
BALL::BaseIterator< Container, DataType, Position, Traits
>
- operator delete() :
BALL::AutoDeletable
- operator double() :
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue
- operator float() :
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue
- operator int() :
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue
- operator long() :
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue
- operator long double() :
BALL::VIEW::ColorUnitHue
- operator new() :
BALL::AutoDeletable
- operator short() :
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue
- operator String() :
BALL::Substring ,
BALL::VIEW::ColorHSV ,
BALL::VIEW::ColorRGBA ,
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue
- operator T() : BALL::TAngle<
T >
- operator unsigned char() :
BALL::VIEW::ColorUnit
- operator unsigned int() :
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue
- operator unsigned long() :
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue
- operator unsigned short() :
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue
- operator!=() : BALL::Protein
, BALL::Element
, BALL::Residue
,
BALL::SecondaryStructure , BALL::System
, BALL::TAngle<
T > , BALL::TBox3<
T > ,
BALL::TCircle3< T > , BALL::TLine3<
T > ,
BALL::TMatrix4x4< T > , BALL::TPlane3<
T > ,
BALL::TSimpleBox3< T > ,
BALL::TSphere3< T > ,
BALL::TVector2< T > ,
BALL::TVector3< T > , BALL::TVector4<
T > ,
BALL::GraphEdge< Vertex, Edge, Face > ,
BALL::GraphFace< Vertex, Edge, Face > ,
BALL::GraphTriangle< Vertex, Edge, Face > ,
BALL::GraphVertex< Vertex, Edge, Face > , BALL::RSEdge
, BALL::RSFace
,
BALL::RSVertex , BALL::SASEdge
, BALL::SASFace
,
BALL::SASVertex , BALL::SESEdge
, BALL::SESFace
,
BALL::SESVertex ,
BALL::Triangle ,
BALL::TriangleEdge ,
BALL::TrianglePoint ,
BALL::Directory , BALL::File
, BALL::Timer
,
BALL::VIEW::ColorHSV ,
BALL::VIEW::ColorRGBA ,
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue ,
BALL::BaseIterator< Container, DataType, Position, Traits
> ,
BALL::Composite ,
BALL::EnumeratorIndex , BALL::Object
,
BALL::NamedProperty ,
BALL::PropertyManager ,
BALL::Selectable , BALL::Bit
,
BALL::BitVector ,
BALL::HashGridBox3< Item > ,
BALL::HashGrid3< Item > , BALL::HashSet<
Key > , BALL::List<
Value > , BALL::Options
,
BALL::Quadruple< T1, T2, T3, T4 > ,
BALL::TRegularData1D< ValueType > ,
BALL::TRegularData2D< ValueType > ,
BALL::TRegularData3D< ValueType > ,
BALL::RegularExpression ,
BALL::Substring ,
BALL::StringHashMap< Value > , BALL::Triple<
T1, T2, T3 > ,
BALL::JCAMPFile ,
BALL::LineBasedFile ,
BALL::NMRStarFile , BALL::PDBInfo
,
BALL::ResourceEntry ,
BALL::ResourceFile , BALL::Atom
,
BALL::AtomContainer , BALL::Bond
, BALL::Chain
,
BALL::ExpressionTree ,
BALL::Fragment ,
BALL::CompositeIteratorTraits ,
BALL::Molecule ,
BALL::NucleicAcid ,
BALL::Nucleotide , BALL::PDBAtom
- operator%() :
BALL::TVector3< T >
- operator%=() :
BALL::TVector3< T >
- operator&() :
BALL::BitVector , BALL::HashSet<
Key >
- operator&=() :
BALL::BitVector , BALL::HashSet<
Key >
- operator()() :
BALL::Pair6_12RDFIntegrator ,
BALL::PairExpRDFIntegrator ,
BALL::AddHydrogenProcessor ,
BALL::AssignBondOrderProcessor ,
BALL::BindingPocketProcessor ,
BALL::BuildBondsProcessor ,
BALL::ClearChargeProcessor ,
BALL::ClearRadiusProcessor ,
BALL::AssignRadiusProcessor ,
BALL::AssignChargeProcessor ,
BALL::DockResult ,
BALL::DockResult::DockResult::Compare_ ,
BALL::EnergeticEvaluation ,
BALL::ForceFieldEvaluation ,
BALL::RandomEvaluation ,
BALL::FragmentDB::FragmentDB::NormalizeNamesProcessor ,
BALL::FragmentDB::FragmentDB::BuildBondsProcessor ,
BALL::BoundingBoxProcessor ,
BALL::GeometricCenterProcessor ,
BALL::FragmentDistanceCollector ,
BALL::TranslationProcessor ,
BALL::TransformationProcessor ,
BALL::HBondProcessor ,
BALL::HybridisationProcessor ,
BALL::RadialDistributionFunction ,
BALL::RDFIntegrator ,
BALL::ReconstructFragmentProcessor ,
BALL::ResidueChecker ,
BALL::SecondaryStructureProcessor ,
BALL::SurfaceProcessor ,
BALL::VIEW::DockResultDialog::DockResultDialog::Compare_
,
BALL::VIEW::AtomBondModelBaseProcessor ,
BALL::VIEW::AddBackboneModel ,
BALL::VIEW::AddBallAndStickModel ,
BALL::VIEW::ColorProcessor ,
BALL::VIEW::ForceModel ,
BALL::VIEW::HBondModelProcessor ,
BALL::VIEW::LabelModel ,
BALL::VIEW::AddLineModel ,
BALL::VIEW::AtomDistanceColorProcessor ,
BALL::VIEW::AddSurfaceModel ,
BALL::VIEW::AddVanDerWaalsModel ,
BALL::Comparator< T > ,
BALL::UnaryProcessor< T > ,
BALL::BinaryProcessor< T1, T2 > ,
BALL::BitVector ,
BALL::TRegularData1D< ValueType > ,
BALL::TRegularData2D< ValueType > ,
BALL::TRegularData3D< ValueType > , BALL::String
,
BALL::EnergyProcessor ,
BALL::Expression ,
BALL::ExpressionPredicate ,
BALL::ExpressionTree ,
BALL::KernelPredicate< T > ,
BALL::Selector ,
BALL::TruePredicate ,
BALL::FalsePredicate ,
BALL::SelectedPredicate ,
BALL::AtomNamePredicate ,
BALL::AtomTypePredicate ,
BALL::ElementPredicate ,
BALL::ResiduePredicate ,
BALL::ResidueIDPredicate ,
BALL::ProteinPredicate ,
BALL::ChainPredicate ,
BALL::SecondaryStructurePredicate ,
BALL::SolventPredicate ,
BALL::MoleculePredicate ,
BALL::BackBonePredicate ,
BALL::NucleotidePredicate ,
BALL::InRingPredicate ,
BALL::NumberOfBondsPredicate ,
BALL::SingleBondsPredicate ,
BALL::DoubleBondsPredicate ,
BALL::TripleBondsPredicate ,
BALL::AromaticBondsPredicate ,
BALL::ConnectedToPredicate ,
BALL::SpHybridizedPredicate ,
BALL::Sp2HybridizedPredicate ,
BALL::Sp3HybridizedPredicate ,
BALL::ChargePredicate ,
BALL::AxialPredicate ,
BALL::Conformation4C1Predicate ,
BALL::RingFinder ,
BALL::SMARTSPredicate ,
BALL::ConstantFunction< constant_template > ,
BALL::MutableConstant< DataType > ,
BALL::Addition< First, Second, DataType > ,
BALL::Subtraction< First, Second, DataType > ,
BALL::Product<
First, Second, DataType > ,
BALL::Division< First, Second, DataType > ,
BALL::Reciprocal< Function, DataType > ,
BALL::SquareFunction< Function, DataType > ,
BALL::CubicFunction< Function, DataType > ,
BALL::MutablePower< Function, DataType > ,
BALL::TMatrix4x4< T > ,
BALL::ParsedFunction< arg > ,
BALL::PiecewiseFunction ,
BALL::PiecewisePolynomial ,
BALL::AssignTypeProcessor ,
BALL::AssignTypeNameProcessor ,
BALL::ChargeRuleProcessor ,
BALL::RadiusRuleProcessor ,
BALL::RuleEvaluator ,
BALL::TypenameRuleProcessor ,
BALL::TypeRuleProcessor ,
BALL::MMFF94ChargeProcessor ,
BALL::AnisotropyShiftProcessor ,
BALL::AssignShiftProcessor ,
BALL::ClearShiftProcessor ,
BALL::CreateSpectrumProcessor ,
BALL::EFShiftProcessor ,
BALL::SimpleExperiment1D ,
BALL::HaighMallionShiftProcessor ,
BALL::HBondShiftProcessor ,
BALL::JohnsonBoveyShiftProcessor ,
BALL::RandomCoilShiftProcessor ,
BALL::ShiftModel ,
BALL::AromaticityProcessor ,
BALL::Descriptor ,
BALL::PartialChargeProcessor ,
BALL::RingPerceptionProcessor ,
BALL::ElectrostaticPotentialCalculator
- operator*() :
BALL::BaseIterator< Container, DataType, Position, Traits
> ,
BALL::BidirectionalIterator< Container, DataType,
Position, Traits > ,
BALL::ForwardIterator< Container, DataType, Position,
Traits > ,
BALL::RandomAccessIterator< Container, DataType, Position,
Traits > ,
BALL::TMatrix4x4< T > ,
BALL::TVector2< T > ,
BALL::TVector3< T > , BALL::TVector4<
T > ,
BALL::Gradient
- operator*=() : BALL::TAngle<
T > ,
BALL::TMatrix4x4< T > ,
BALL::TVector2< T > ,
BALL::TVector3< T > , BALL::TVector4<
T > ,
BALL::GraphEdge< Vertex, Edge, Face > ,
BALL::GraphFace< Vertex, Edge, Face > ,
BALL::GraphTriangle< Vertex, Edge, Face > ,
BALL::GraphVertex< Vertex, Edge, Face > , BALL::RSEdge
, BALL::RSFace
,
BALL::RSVertex , BALL::SASEdge
, BALL::SASFace
,
BALL::SASVertex , BALL::SESEdge
, BALL::SESFace
,
BALL::SESVertex ,
BALL::Triangle ,
BALL::TriangleEdge ,
BALL::TrianglePoint
- operator+() :
BALL::BaseIterator< Container, DataType, Position, Traits
> , BALL::HashSet<
Key > , BALL::String
, BALL::TAngle<
T > ,
BALL::TMatrix4x4< T > ,
BALL::TVector2< T > ,
BALL::TVector3< T > , BALL::TVector4<
T >
- operator++() :
BALL::ConstBidirectionalIterator< Container, DataType,
Position, Traits > ,
BALL::BidirectionalIterator< Container, DataType,
Position, Traits > ,
BALL::EnumeratorIndex ,
BALL::ConstForwardIterator< Container, DataType, Position,
Traits > ,
BALL::ForwardIterator< Container, DataType, Position,
Traits >
- operator+=() : BALL::HashSet<
Key > , BALL::TAngle<
T > ,
BALL::TMatrix4x4< T > ,
BALL::TVector2< T > ,
BALL::TVector3< T > , BALL::TVector4<
T > ,
BALL::TriangulatedSurface
- operator-() :
BALL::BaseIterator< Container, DataType, Position, Traits
> , BALL::HashSet<
Key > , BALL::TAngle<
T > ,
BALL::TMatrix4x4< T > ,
BALL::TVector2< T > ,
BALL::TVector3< T > , BALL::TVector4<
T >
- operator--() :
BALL::ConstBidirectionalIterator< Container, DataType,
Position, Traits > ,
BALL::BidirectionalIterator< Container, DataType,
Position, Traits > ,
BALL::EnumeratorIndex
- operator-=() : BALL::HashSet<
Key > , BALL::TAngle<
T > ,
BALL::TMatrix4x4< T > ,
BALL::TVector2< T > ,
BALL::TVector3< T > , BALL::TVector4<
T >
- operator->() :
BALL::LogStream ,
BALL::BaseIterator< Container, DataType, Position, Traits
> ,
BALL::BidirectionalIterator< Container, DataType,
Position, Traits > ,
BALL::ForwardIterator< Container, DataType, Position,
Traits > ,
BALL::RandomAccessIterator< Container, DataType, Position,
Traits >
- operator/() : BALL::TAngle<
T > ,
BALL::TMatrix4x4< T > ,
BALL::TVector2< T > ,
BALL::TVector3< T > , BALL::TVector4<
T >
- operator/=() : BALL::TAngle<
T > ,
BALL::TMatrix4x4< T > ,
BALL::TVector2< T > ,
BALL::TVector3< T > , BALL::TVector4<
T >
- operator<() :
BALL::EnumeratorIndex , BALL::Object
,
BALL::PreciseTime ,
BALL::Quadruple< T1, T2, T3, T4 > ,
BALL::RegularExpression , BALL::Triple<
T1, T2, T3 > ,
BALL::INIFile::INIFile::Section , BALL::Element
, BALL::TAngle<
T > ,
BALL::TVector3< T > , BALL::Peak<
PositionType > , BALL::Timer
,
BALL::VIEW::ColorHSV ,
BALL::VIEW::ColorRGBA ,
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue ,
BALL::VIEW::GeometricObject ,
BALL::VIEW::Representation ,
BALL::VIEW::LightSource ,
BALL::VIEW::Camera
- operator<<() :
BALL::EnumeratorIndex ,
BALL::PersistenceManager ,
BALL::BitVector ,
BALL::TContourSurface< T > ,
BALL::RegularExpression ,
BALL::Substring ,
BALL::GenericMolFile , BALL::PDBFile
, BALL::Element
,
BALL::BindingPocketProcessor ,
BALL::DockResult ,
BALL::VIEW::ColorHSV ,
BALL::VIEW::ColorRGBA ,
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue
- operator<=() :
BALL::EnumeratorIndex , BALL::Object
,
BALL::Quadruple< T1, T2, T3, T4 > ,
BALL::RegularExpression , BALL::Triple<
T1, T2, T3 > , BALL::Element
, BALL::TAngle<
T > , BALL::Timer
,
BALL::VIEW::ColorHSV ,
BALL::VIEW::ColorRGBA ,
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue
- operator=() :
BALL::BondPolarizabilities ,
BALL::VIEW::DockingController ,
BALL::NMRStarFile ,
BALL::Parameters ,
BALL::VertexAdjacencyEquality ,
BALL::ParameterSection , BALL::PDBInfo
,
BALL::PDBRecords ,
BALL::NumberOfHeavyBonds ,
BALL::NumberOfAromaticAtoms ,
BALL::ResourceEntry ,
BALL::SCWRLRotamerFile ,
BALL::AtomInformationContent ,
BALL::TrajectoryFile , BALL::TRRFile
, BALL::Atom
,
BALL::NumberOfHydrogen ,
BALL::NumberOfIodine ,
BALL::AtomContainer , BALL::Bond
,
BALL::NumberOfSulfur , BALL::Chain
,
BALL::Expression ,
BALL::ExpressionPredicate ,
BALL::NumberOfNitrogen ,
BALL::ExpressionTree ,
BALL::Fragment ,
BALL::CompositeIteratorTraits ,
BALL::Molecule ,
BALL::NucleicAcid ,
BALL::Nucleotide , BALL::PDBAtom
,
BALL::NumberOfBonds , BALL::Protein
, BALL::Element
, BALL::PTE_
,
BALL::PartialChargeProcessor , BALL::Residue
,
BALL::SecondaryStructure ,
BALL::Selector ,
BALL::TotalPositivePartialCharge , BALL::System
, BALL::TAngle<
T > , BALL::TBox3<
T > ,
BALL::TCircle3< T > , BALL::TFFT1D<
ComplexTraits > , BALL::TFFT2D<
ComplexTraits > ,
BALL::PyCompositeList , BALL::TFFT3D<
ComplexTraits > ,
BALL::MutableConstant< DataType > ,
BALL::Addition< First, Second, DataType > ,
BALL::Peak<
PositionType > ,
BALL::Subtraction< First, Second, DataType > ,
BALL::Product<
First, Second, DataType > ,
BALL::Division< First, Second, DataType > ,
BALL::LennardJones ,
BALL::Reciprocal< Function, DataType > ,
BALL::SquareFunction< Function, DataType > ,
BALL::CubicFunction< Function, DataType > ,
BALL::MutablePower< Function, DataType > ,
BALL::TLine3<
T > ,
BALL::TMatrix4x4< T > ,
BALL::MMFF94TorsionParameters ,
BALL::TMatrix4x4< T > ,
BALL::NumericalIntegrator< Function, DataType > ,
BALL::PiecewiseFunction ,
BALL::MMFF94ParametersBase ,
BALL::PiecewisePolynomial , BALL::TPlane3<
T > ,
BALL::TQuaternion< T > ,
BALL::SteepestDescentMinimizer ,
BALL::TQuaternion< T > ,
BALL::RombergIntegrator< Function, DataType > ,
BALL::TSimpleBox3< T > ,
BALL::TSphere3< T > ,
BALL::TVector2< T > ,
BALL::SnapShotManager ,
BALL::TVector3< T > ,
BALL::Gradient , BALL::TVector4<
T > , BALL::AmberFF
,
BALL::AmberNonBonded ,
BALL::CharmmFF ,
BALL::CharmmNonBonded ,
BALL::AtomVector ,
BALL::ForceField ,
BALL::Gradient ,
BALL::PeriodicBoundary ,
BALL::RuleEvaluator ,
BALL::SnapShot ,
BALL::CanonicalMD ,
BALL::MicroCanonicalMD ,
BALL::MolecularDynamics ,
BALL::ConjugateGradientMinimizer ,
BALL::EnergyMinimizer ,
BALL::LineSearch ,
BALL::ShiftedLVMMMinimizer ,
BALL::StrangLBFGSMinimizer , BALL::MMFF94
,
BALL::MMFF94NonBonded ,
BALL::MMFF94StretchParameters ,
BALL::MMFF94BendParameters ,
BALL::MMFF94StretchBendParameters ,
BALL::MMFF94PlaneParameters ,
BALL::MMFF94VDWParameters ,
BALL::MMFF94ESParameters ,
BALL::AtomTypes ,
BALL::CharmmEEF1 ,
BALL::CosineTorsion ,
BALL::ForceFieldParameters ,
BALL::Potential1210 ,
BALL::QuadraticImproperTorsion ,
BALL::Templates ,
BALL::ShiftModel ,
BALL::ShiftModule ,
BALL::PyDatasetVector ,
BALL::AromaticityProcessor ,
BALL::ConnectivityBase ,
BALL::ZagrebIndex ,
BALL::BalabanIndexJ ,
BALL::Descriptor ,
BALL::PartialChargeBase ,
BALL::TotalNegativePartialCharge ,
BALL::RelPositivePartialCharge ,
BALL::RelNegativePartialCharge ,
BALL::RingPerceptionProcessor ,
BALL::SimpleBase ,
BALL::MolecularWeight ,
BALL::TriangulatedSES ,
BALL::VIEW::ColorProcessor ,
BALL::NumberOfSingleBonds ,
BALL::NumberOfDoubleBonds ,
BALL::NumberOfTripleBonds ,
BALL::NumberOfAromaticBonds ,
BALL::NumberOfAtoms ,
BALL::NumberOfBoron ,
BALL::NumberOfCarbon ,
BALL::VIEW::Sphere ,
BALL::NumberOfOxygen ,
BALL::NumberOfFlourine ,
BALL::NumberOfPhosphorus ,
BALL::NumberOfChlorine ,
BALL::NumberOfBromine ,
BALL::VIEW::TwoColoredLine ,
BALL::VIEW::HBondModelProcessor ,
BALL::VIEW::Mesh ,
BALL::FormalCharge ,
BALL::NumberOfHeavyAtoms ,
BALL::MeanAtomInformationContent ,
BALL::NumberOfRotatableSingleBonds ,
BALL::LineBasedFile ,
BALL::RelNumberOfRotatableSingleBonds ,
BALL::VIEW::Point ,
BALL::VIEW::Box ,
BALL::GAMESSDatFile ,
BALL::NumberOfRotatableBonds ,
BALL::RelNumberOfRotatableBonds ,
BALL::VertexAdjacency ,
BALL::ComposedEnergyProcessor ,
BALL::NumberOfHydrogenBondAcceptors ,
BALL::NumberOfHydrogenBondDonors ,
BALL::NumberOfHydrophobicAtoms ,
BALL::VIEW::ColorUnitHue ,
BALL::VIEW::DockDialog ,
BALL::VIEW::AtomBondModelBaseProcessor ,
BALL::AtomicPolarizabilities , BALL::String
,
BALL::SizeOfSSSR ,
BALL::PrincipalMomentOfInertia ,
BALL::PrincipalMomentOfInertiaY , BALL::String
,
BALL::PrincipalMomentOfInertiaZ ,
BALL::SurfaceBase ,
BALL::VIEW::DockResultDialog , BALL::String
,
BALL::NegativeVdWSurface ,
BALL::PositivePolarVdWSurface ,
BALL::NegativePolarVdWSurface ,
BALL::PolarVdWSurface ,
BALL::RelPositiveVdWSurface ,
BALL::VIEW::GeometricObject ,
BALL::VIEW::ColorUnitHue ,
BALL::Quadruple< T1, T2, T3, T4 > ,
BALL::VIEW::Dataset ,
BALL::RelNegativePolarVdWSurface ,
BALL::RelHydrophobicVdWSurface ,
BALL::HashGrid3< Item > ,
BALL::RelPolarVdWSurface , BALL::Density
,
BALL::VdWSurface ,
BALL::BitVector ,
BALL::VIEW::Vertex2 ,
BALL::VIEW::ColorUnitHue ,
BALL::HydrogenBond ,
BALL::Lipophilic ,
BALL::ChemScoreMetal ,
BALL::PolarSolvation ,
BALL::RotationalEntropyLoss , BALL::Object
,
BALL::SLICKEnergy ,
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorUnitHue ,
BALL::ClaverieParameter ,
BALL::Pair6_12InteractionEnergyProcessor ,
BALL::Pair6_12RDFIntegrator ,
BALL::PairExpInteractionEnergyProcessor ,
BALL::PairExpRDFIntegrator ,
BALL::PCMCavFreeEnergyProcessor ,
BALL::PierottiCavFreeEnergyProcessor ,
BALL::VIEW::ColorUnitHue ,
BALL::SolventDescriptor ,
BALL::SolventParameter ,
BALL::UhligCavFreeEnergyProcessor ,
BALL::BindingPocketProcessor ,
BALL::BuildBondsProcessor ,
BALL::DockResult ,
BALL::VIEW::ColorUnit ,
BALL::FragmentDB ,
BALL::GraphEdge< Vertex, Edge, Face > ,
BALL::GraphFace< Vertex, Edge, Face > ,
BALL::GraphVertex< Vertex, Edge, Face > ,
BALL::HybridisationProcessor ,
BALL::RadialDistributionFunction ,
BALL::VIEW::ColorUnit ,
BALL::RDFParameter ,
BALL::ReducedSurface ,
BALL::ResidueRotamerSet , BALL::RSEdge
, BALL::RSFace
,
BALL::RSVertex ,
BALL::VIEW::ColorHSV ,
BALL::VIEW::ColorUnit , BALL::SASFace
,
BALL::SASVertex , BALL::SESEdge
,
BALL::SESVertex ,
BALL::SmartsMatcher::SmartsMatcher::RecStructCore_ ,
BALL::SmartsMatcher::SmartsMatcher::RecStruct_ ,
BALL::VIEW::ColorRGBA ,
BALL::Triangle ,
BALL::TrianglePoint ,
BALL::TriangulatedSAS ,
BALL::TriangulatedSurface ,
BALL::TriangulatedSphere ,
BALL::VIEW::ColorRGBA ,
BALL::Directory ,
BALL::VIEW::ColorHSV , BALL::Timer
,
BALL::VIEW::ColorExtension2 ,
BALL::VIEW::MultiColorExtension ,
BALL::VIEW::ColorHSV , BALL::File
,
BALL::VIEW::ColorRGBA ,
BALL::VIEW::TwoColoredTube ,
BALL::VIEW::ColorUnit ,
BALL::VIEW::SimpleBox ,
BALL::HydrophobicVdWSurface ,
BALL::VIEW::ColorUnit ,
BALL::VIEW::DockingThread ,
BALL::VIEW::ColorUnit ,
BALL::SmartsParser::SmartsParser::SPAtom::SmartsParser::SPAtom::Property
,
BALL::VIEW::ColorUnitHue , BALL::SESFace
,
BALL::VIEW::ColorUnitHue ,
BALL::VIEW::Vertex , BALL::SASEdge
,
BALL::VIEW::GeometricFitDialog ,
BALL::VIEW::AddBallAndStickModel ,
BALL::RotamerLibrary ,
BALL::VIEW::Disc ,
BALL::VIEW::Label ,
BALL::VIEW::Line ,
BALL::VIEW::MultiLine ,
BALL::RDFIntegrator ,
BALL::VIEW::Tube ,
BALL::VIEW::Scene ,
BALL::GraphTriangle< Vertex, Edge, Face > ,
BALL::DockResult::DockResult::Scoring_ ,
BALL::AssignBondOrderProcessor ,
BALL::ReissCavFreeEnergyProcessor ,
BALL::SLICKScore ,
BALL::BuriedPolar ,
BALL::NonpolarSolvation , BALL::CHPI
,
BALL::RelNegativeVdWSurface ,
BALL::VdWVolume ,
BALL::RelPositivePolarVdWSurface ,
BALL::PrincipalMomentOfInertiaX ,
BALL::PositiveVdWSurface ,
BALL::BaseIterator< Container, DataType, Position, Traits
> ,
BALL::Composite ,
BALL::EnumeratorIndex ,
BALL::PropertyManager ,
BALL::Selectable ,
BALL::PreciseTime ,
BALL::TimeStamp , BALL::Bit
,
BALL::BitVector ,
BALL::TContour< T > ,
BALL::TContourLine< T > ,
BALL::TContourSurface< T > , BALL::HashSet<
Key > , BALL::List<
Value > , BALL::Options
,
BALL::TRegularData1D< ValueType > ,
BALL::TRegularData2D< ValueType > ,
BALL::TRegularData3D< ValueType > ,
BALL::RegularExpression , BALL::String
,
BALL::Substring ,
BALL::StringHashMap< Value > , BALL::Triple<
T1, T2, T3 > ,
BALL::EnergyProcessor , BALL::DCDFile
,
BALL::DSN6File ,
BALL::GAMESSLogFile ,
BALL::GenericMolFile , BALL::HINFile
- operator==() :
BALL::CharmmNonBonded ,
BALL::Pair6_12RDFIntegrator ,
BALL::TimeStamp ,
BALL::PierottiCavFreeEnergyProcessor ,
BALL::Timer ,
BALL::TVector2< T > ,
BALL::VIEW::ColorHSV ,
BALL::VIEW::ColorUnitHue ,
BALL::VIEW::ColorRGBA ,
BALL::VIEW::ColorUnit ,
BALL::Subtraction< First, Second, DataType > ,
BALL::TrianglePoint , BALL::SESEdge
,
BALL::Directory ,
BALL::AtomTypes ,
BALL::PropertyManager , BALL::SESFace
,
BALL::TriangleEdge ,
BALL::SESVertex , BALL::SASEdge
,
BALL::RDFIntegrator , BALL::SASFace
,
BALL::Composite ,
BALL::HashGridBox3< Item > ,
BALL::RDFSection ,
BALL::RSVertex ,
BALL::TContour< T > , BALL::RSEdge
, BALL::RSFace
,
BALL::Potential1210 ,
BALL::UhligCavFreeEnergyProcessor ,
BALL::GraphTriangle< Vertex, Edge, Face > ,
BALL::Bit
,
BALL::SolventDescriptor ,
BALL::GraphVertex< Vertex, Edge, Face > ,
BALL::GraphFace< Vertex, Edge, Face > ,
BALL::ForceFieldParameters , BALL::HashMap<
Key, T > , BALL::Product<
First, Second, DataType > ,
BALL::PCMCavFreeEnergyProcessor ,
BALL::HashGrid3< Item > ,
BALL::PairExpRDFIntegrator ,
BALL::Pair6_12InteractionEnergyProcessor ,
BALL::ClaverieParameter , BALL::Peak<
PositionType > ,
BALL::LennardJones , BALL::HashSet<
Key > ,
BALL::TContourSurface< T > ,
BALL::BaseIterator< Container, DataType, Position, Traits
> ,
BALL::TContourLine< T > , BALL::Bit
,
BALL::Selectable ,
BALL::EnumeratorIndex ,
BALL::SolventParameter ,
BALL::TMatrix4x4< T > ,
BALL::TCircle3< T > ,
BALL::RegularExpression ,
BALL::GraphEdge< Vertex, Edge, Face > ,
BALL::DSN6File ,
BALL::Substring ,
BALL::TRegularData1D< ValueType > ,
BALL::ComposedEnergyProcessor , BALL::Triple<
T1, T2, T3 > ,
BALL::JCAMPFile ,
BALL::NMRStarFile ,
BALL::Parameters ,
BALL::RadialDistributionFunction ,
BALL::ParameterSection ,
BALL::ResourceEntry ,
BALL::PiecewisePolynomial ,
BALL::AtomContainer ,
BALL::Division< First, Second, DataType > ,
BALL::CubicFunction< Function, DataType > ,
BALL::Atom
,
BALL::TrajectoryFile ,
BALL::SquareFunction< Function, DataType > ,
BALL::Triangle ,
BALL::TVector3< T > ,
BALL::ExpressionTree ,
BALL::VIEW::GeometricObject ,
BALL::CompositeIteratorTraits ,
BALL::NucleicAcid , BALL::PDBAtom
,
BALL::ExpressionPredicate , BALL::Residue
, BALL::TAngle<
T > ,
BALL::CosineTorsion ,
BALL::Selector ,
BALL::AmberNonBonded ,
BALL::MutableConstant< DataType > ,
BALL::Quadruple< T1, T2, T3, T4 > , BALL::Element
,
BALL::Molecule ,
BALL::BitVector ,
BALL::TSimpleBox3< T > ,
BALL::PiecewiseFunction , BALL::Protein
,
BALL::RuleEvaluator ,
BALL::Fragment ,
BALL::RombergIntegrator< Function, DataType > ,
BALL::SecondaryStructure , BALL::PDBInfo
,
BALL::LineBasedFile , BALL::TBox3<
T > ,
BALL::StringHashMap< Value > ,
BALL::Substring , BALL::TPlane3<
T > , BALL::TFFT2D<
ComplexTraits > , BALL::Object
,
BALL::NamedProperty ,
BALL::PreciseTime ,
BALL::TRegularData3D< ValueType > ,
BALL::SnapShot , BALL::TFFT3D<
ComplexTraits > , BALL::TVector4<
T > , BALL::List<
Value > , BALL::Options
,
BALL::TRegularData2D< ValueType > ,
BALL::MMFF94NonBonded , BALL::PTE_
, BALL::DCDFile
,
BALL::Reciprocal< Function, DataType > ,
BALL::MutablePower< Function, DataType > ,
BALL::Chain
,
BALL::Expression ,
BALL::Nucleotide , BALL::System
, BALL::TFFT1D<
ComplexTraits > ,
BALL::Addition< First, Second, DataType > ,
BALL::TLine3<
T > ,
BALL::NumericalIntegrator< Function, DataType > ,
BALL::INIFile
,
BALL::CharmmEEF1 ,
BALL::TSphere3< T > , BALL::TRRFile
,
BALL::EnergyMinimizer ,
BALL::ReissCavFreeEnergyProcessor , BALL::Bond
,
BALL::QuadraticImproperTorsion ,
BALL::ResourceFile ,
BALL::SASVertex , BALL::File
,
BALL::Substring ,
BALL::EnergyProcessor ,
BALL::Substring
- operator>() : BALL::TAngle<
T > ,
BALL::VIEW::ColorRGBA , BALL::Triple<
T1, T2, T3 > , BALL::Peak<
PositionType > ,
BALL::EnumeratorIndex ,
BALL::VIEW::ColorHSV ,
BALL::VIEW::ColorUnitHue ,
BALL::RegularExpression ,
BALL::PreciseTime ,
BALL::Quadruple< T1, T2, T3, T4 > ,
BALL::VIEW::ColorUnit , BALL::Object
,
BALL::INIFile::INIFile::Section , BALL::Timer
, BALL::Element
- operator>=() :
BALL::VIEW::ColorUnit ,
BALL::VIEW::ColorRGBA , BALL::Object
, BALL::Element
,
BALL::EnumeratorIndex ,
BALL::RegularExpression ,
BALL::VIEW::ColorHSV ,
BALL::Quadruple< T1, T2, T3, T4 > , BALL::Timer
, BALL::TAngle<
T > ,
BALL::VIEW::ColorUnitHue , BALL::Triple<
T1, T2, T3 >
- operator>>() : BALL::PDBFile
,
BALL::GenericMolFile ,
BALL::RegularExpression ,
BALL::GenericMolFile ,
BALL::VIEW::ColorUnit ,
BALL::PersistentObject ,
BALL::SCWRLRotamerFile ,
BALL::VIEW::ColorUnitHue ,
BALL::DockResult ,
BALL::VIEW::ColorHSV ,
BALL::VIEW::ColorRGBA , BALL::TRRFile
,
BALL::BitVector , BALL::PDBFile
,
BALL::PersistenceManager , BALL::PDBFile
- operator[]() : BALL::PTE_
,
BALL::TRegularData3D< ValueType > , BALL::TFFT3D<
ComplexTraits > , BALL::PTE_
,
BALL::TRegularData2D< ValueType > , BALL::TVector4<
T > ,
BALL::TVector2< T > , BALL::PTE_
, BALL::TFFT3D<
ComplexTraits > ,
BALL::Substring ,
BALL::ResidueRotamerSet , BALL::TFFT1D<
ComplexTraits > , BALL::TFFT2D<
ComplexTraits > , BALL::TFFT1D<
ComplexTraits > , BALL::PTE_
,
BALL::TRegularData3D< ValueType > , BALL::PTE_
, BALL::TFFT2D<
ComplexTraits > , BALL::PTE_
, BALL::TFFT3D<
ComplexTraits > ,
BALL::TMatrix4x4< T > , BALL::TVector4<
T > ,
BALL::BitVector ,
BALL::TRegularData1D< ValueType > ,
BALL::ConformationSet ,
BALL::TVector3< T > ,
BALL::TRegularData2D< ValueType > , BALL::TFFT3D<
ComplexTraits > , BALL::TFFT2D<
ComplexTraits > , BALL::TFFT1D<
ComplexTraits > ,
BALL::TRegularData2D< ValueType > ,
BALL::BitVector ,
BALL::TRegularData3D< ValueType > , BALL::TFFT2D<
ComplexTraits > , BALL::HashMap<
Key, T > ,
BALL::EnumeratorIndex , BALL::PTE_
,
BALL::TRegularData3D< ValueType > , BALL::HashMap<
Key, T > , BALL::TFFT2D<
ComplexTraits > ,
BALL::EnumeratorIndex ,
BALL::TRegularData2D< ValueType > ,
BALL::TVector3< T > ,
BALL::TRegularData1D< ValueType > ,
BALL::TMatrix4x4< T > ,
BALL::Substring ,
BALL::TVector2< T > ,
BALL::AtomVector
- operator^() :
BALL::BitVector
- operator^=() :
BALL::BitVector
- operator|() : BALL::HashSet<
Key > ,
BALL::BitVector
- operator|=() :
BALL::BitVector , BALL::HashSet<
Key >
- operator~() :
BALL::BitVector
- optimizeGridSize_() :
BALL::GeometricFit
- options :
BALL::BuildBondsProcessor ,
BALL::ForceField ,
BALL::Pair6_12RDFIntegrator ,
BALL::Pair6_12InteractionEnergyProcessor ,
BALL::AssignBondOrderProcessor ,
BALL::PeriodicBoundary
- Options() : BALL::Options
- options :
BALL::SnapShotManager ,
BALL::AromaticityProcessor , BALL::FDPB
,
BALL::MolecularDynamics ,
BALL::ShiftModel ,
BALL::ReissCavFreeEnergyProcessor ,
BALL::UhligCavFreeEnergyProcessor
- Options() : BALL::Options
- options :
BALL::BindingPocketProcessor ,
BALL::PairExpInteractionEnergyProcessor ,
BALL::ElectrostaticPotentialCalculator ,
BALL::ParameterSection ,
BALL::HybridisationProcessor ,
BALL::DockingAlgorithm ,
BALL::GeometricFit ,
BALL::SDGenerator ,
BALL::PierottiCavFreeEnergyProcessor ,
BALL::PDBFile ,
BALL::EnergyMinimizer ,
BALL::PCMCavFreeEnergyProcessor
- options_ :
BALL::DockResult::DockResult::Scoring_
- OR :
BALL::ExpressionTree
- Order : BALL::Bond
- ORDER__ANY :
BALL::Bond
- ORDER__AROMATIC :
BALL::Bond
- ORDER__DOUBLE :
BALL::Bond
- ORDER__QUADRUPLE :
BALL::Bond
- ORDER__SINGLE :
BALL::Bond
- ORDER__TRIPLE :
BALL::Bond
- ORDER__UNKNOWN :
BALL::Bond
- origin_ : BALL::TFFT2D<
ComplexTraits > , BALL::TFFT3D<
ComplexTraits > ,
BALL::TRegularData1D< ValueType > ,
BALL::DSN6File , BALL::TFFT1D<
ComplexTraits > ,
BALL::TRegularData3D< ValueType > ,
BALL::TRegularData2D< ValueType >
- original_coordinates_ :
BALL::ResidueRotamerSet
- other() :
BALL::GraphEdge< Vertex, Edge, Face >
- output_() :
BALL::VIEW::BALLThread
- outputEnabled() :
BALL::LogStream
- overflow() :
BALL::LogStreamBuf
- OVERWRITE_BOND_ORDERS :
BALL::AromaticityProcessor::AromaticityProcessor::Option
- OVERWRITE_CHARGES :
BALL::CharmmFF::CharmmFF::Default ,
BALL::MMFF94::MMFF94::Option ,
BALL::AmberFF::AmberFF::Option ,
BALL::CharmmFF::CharmmFF::Option ,
BALL::MMFF94::MMFF94::Default ,
BALL::AmberFF::AmberFF::Default
- OVERWRITE_DOUBLE_BOND_ORDERS :
BALL::AssignBondOrderProcessor::AssignBondOrderProcessor::Option
- OVERWRITE_SELECTED_BONDS :
BALL::AssignBondOrderProcessor::AssignBondOrderProcessor::Option
- OVERWRITE_SINGLE_BOND_ORDERS :
BALL::AssignBondOrderProcessor::AssignBondOrderProcessor::Option
- OVERWRITE_TRIPLE_BOND_ORDERS :
BALL::AssignBondOrderProcessor::AssignBondOrderProcessor::Option
- OVERWRITE_TYPENAMES :
BALL::MMFF94::MMFF94::Default ,
BALL::MMFF94::MMFF94::Option ,
BALL::AmberFF::AmberFF::Default ,
BALL::AmberFF::AmberFF::Option ,
BALL::CharmmFF::CharmmFF::Option ,
BALL::CharmmFF::CharmmFF::Default