Here is a list of all class members with links to the classes
they belong to:
- a :
BALL::PDB::RecordCRYST1::UnitCell ,
BALL::PDB::Structure::UnitCellInfo ,
BALL::BindingPocketProcessor::Sphere_
- A :
BALL::Potential1210::Values
- a :
BALL::SortedPosition2 ,
BALL::TSimpleBox3< T > ,
BALL::SortedPosition3
- A :
BALL::LennardJones::Values
- a0 :
BALL::Constant
- a1 :
BALL::HybridisationProcessor::AtomNames_
- a2 :
BALL::HybridisationProcessor::AtomNames_
- a3 :
BALL::HybridisationProcessor::AtomNames_
- A_ :
BALL::Pair6_12RDFIntegrator ,
BALL::StructureMapper
- a_ :
BALL::FermiBaseFunction
- A_ :
BALL::LennardJones ,
BALL::Potential1210
- A_B_FORMAT :
BALL::LennardJones
- a_i_ :
BALL::ConjugateGradientMinimizer
- A_STAR :
BALL::AssignBondOrderProcessor::Algorithm
- abbreviation_common :
BALL::NMRStarFile::MolecularSystem
- abonds :
BALL::Kekuliser::AtomInfo
- abort() :
BALL::DockingAlgorithm ,
BALL::VIEW::DownloadElectronDensity ,
BALL::VIEW::DownloadPDBFile
- ABORT :
BALL::Processor
- abort_ :
BALL::DockingAlgorithm ,
BALL::VIEW::DockingFinishedMessage
- abort_by_energy_enabled_ :
BALL::MolecularDynamics ,
BALL::EnergyMinimizer
- abort_energy_ :
BALL::EnergyMinimizer ,
BALL::MolecularDynamics
- abort_test :
BALL::VIEW::TestFramework
- abortClicked() :
BALL::VIEW::DockProgressDialog
- aborted_ :
BALL::EnergyMinimizer ,
BALL::VIEW::DownloadElectronDensity ,
BALL::VIEW::DownloadPDBFile
- abortScript() :
BALL::VIEW::PyWidget
- abortTest() :
BALL::VIEW::TestFramework
- about() :
BALL::Mainframe
- about_to_quit_ :
BALL::VIEW::MainControl
- aboutToExit() :
BALL::VIEW::MainControl
- ABSOLUTE_TEMPERATURE :
BALL::NonpolarSolvation::Option ,
BALL::NonpolarSolvation::Default ,
BALL::PCMCavFreeEnergyProcessor::Option ,
BALL::PCMCavFreeEnergyProcessor::Default ,
BALL::PierottiCavFreeEnergyProcessor::Option ,
BALL::PierottiCavFreeEnergyProcessor::Default ,
BALL::ReissCavFreeEnergyProcessor::Option ,
BALL::ReissCavFreeEnergyProcessor::Default
- absolute_temperature_ :
BALL::NonpolarSolvation
- Ac :
BALL::Element
- ac :
BALL::AssignBondOrderProcessor::Solution_
- ac_ :
BALL::GeneralizedBornModel ,
BALL::AssignBondOrderProcessor ,
BALL::VIEW::FieldLineCreator
- ac_split_() :
BALL::AntechamberFile
- accept() :
BALL::VIEW::EditSingleShortcut ,
BALL::VIEW::ExportGeometryDialog ,
BALL::VIEW::FDPBDialog ,
BALL::VIEW::FieldLinesDialog ,
BALL::VIEW::GeometricFitDialog ,
BALL::VIEW::GridVisualizationDialog ,
BALL::VIEW::LabelDialog ,
BALL::VIEW::MinimizationDialog ,
BALL::VIEW::MMFF94ConfigurationDialog ,
BALL::VIEW::ModifyRepresentationDialog ,
BALL::VIEW::MolecularDynamicsDialog ,
BALL::VIEW::RaytraceableContourSurfaceDialog ,
BALL::VIEW::RunGAMESSDialog ,
BALL::VIEW::AmberConfigurationDialog ,
BALL::VIEW::AssignBondOrderConfigurationDialog ,
BALL::VIEW::AtomOverview ,
BALL::VIEW::CharmmConfigurationDialog ,
BALL::VIEW::ClippingDialog ,
BALL::VIEW::CompositeProperties
- acceptCombinedDatapoints() :
BALL::MPISupport
- acceptDatapoints() :
BALL::MPISupport
- acceptor_ :
BALL::HBondProcessor::HBond ,
BALL::TCPServer
- acceptor_occupied_ :
BALL::HBondShiftProcessor
- acceptor_types_ :
BALL::HBondShiftProcessor
- acceptors_ :
BALL::HBondShiftProcessor ,
BALL::HBondProcessor
- accession_code :
BALL::NMRStarFile::MonomericPolymer::HomologDB ,
BALL::NMRStarFile::MolecularSystem::RelatedDB
- acidic_color_ :
BALL::VIEW::ResidueTypeColorProcessor
- ACTINIUM :
BALL::Element
- action :
BALL::VIEW::Hotkey
- action1_ :
BALL::VIEW::PubChemDialog
- action2_ :
BALL::VIEW::PubChemDialog
- action_ :
BALL::VIEW::UndoManagerDialog ,
BALL::VIEW::DockingController ,
BALL::VIEW::TestFramework
- actions_ :
BALL::VIEW::DatasetController
- actions_for_one_set_ :
BALL::VIEW::DatasetController
- activate() :
BALL::BALLPlugin ,
BALL::TCPServer ,
BALL::VIEW::ServerWidget
- activate_async() :
BALL::TCPServerThread
- activated_item_ :
BALL::VIEW::AssignBondOrderResultsDialog
- activatedItem_() :
BALL::VIEW::MolecularControl
- activatedOrderItem_() :
BALL::VIEW::EditableScene
- active_ :
BALL::VIEW::ClippingPlane
- active_index_ :
BALL::VIEW::PluginDialog
- ACTIVE_STEREO :
BALL::VIEW::GLRenderer
- active_stereo_action_ :
BALL::VIEW::Scene
- activities :
BALL::QSAR::InputConfiguration
- adapt_char_ :
BALL::TRRFile
- adapt_double_ :
BALL::TRRFile
- adapt_float_ :
BALL::DCDFile ,
BALL::TRRFile
- adapt_size_ :
BALL::DCDFile ,
BALL::TRRFile
- add() :
BALL::ConformationSet ,
BALL::SmartsMatcher::RecStruct_ ,
BALL::VIEW::RaytraceableContourSurfaceDialog
- ADD :
BALL::FragmentDB::NormalizeNamesProcessor ,
BALL::VIEW::DatasetMessage ,
BALL::VIEW::RepresentationMessage
- add_button_ :
BALL::VIEW::PubChemDialog
- ADD_CHAIN_RESIDUE_ID :
BALL::Atom
- ADD_HBONDS :
BALL::HBondProcessor::Option ,
BALL::HBondProcessor::Default
- ADD_HYDROGENS :
BALL::AssignBondOrderProcessor::Option ,
BALL::AssignBondOrderProcessor::Default ,
BALL::VIEW::MolecularTaskMessage
- add_hydrogens :
BALL::FragmentDB
- add_hydrogens_action_ :
BALL::VIEW::EditableScene
- add_hydrogens_id_ :
BALL::VIEW::MolecularStructure
- add_missing_hydrogens_ :
BALL::AssignBondOrderProcessor
- ADD_RESIDUE_ID :
BALL::Atom ,
BALL::Residue
- ADD_TO_GEOMETRIC_CONTROL :
BALL::VIEW::RepresentationMessage
- ADD_VARIANT_EXTENSIONS :
BALL::Atom ,
BALL::Residue
- ADD_VARIANT_EXTENSIONS_AND_CHAIN_RESIDUE_ID :
BALL::Atom
- ADD_VARIANT_EXTENSIONS_AND_ID :
BALL::Atom ,
BALL::Residue
- addAlgorithm() :
BALL::VIEW::DockDialog
- addAllRecords_() :
BALL::PDBFile
- addAminoAcid() :
BALL::Peptides::PeptideBuilder
- addAtom() :
BALL::VIEW::AtomDistanceColorProcessor
- AddBackboneModel() :
BALL::VIEW::AddBackboneModel
- AddBallAndStickModel() :
BALL::VIEW::AddBallAndStickModel
- addBasisOption() :
BALL::GAMESSLogFile
- AddCartoonModel() :
BALL::VIEW::AddCartoonModel
- addCESelementConnectionPredicate() :
BALL::GAFFCESParser::CESPredicate
- addCESelementPredicate() :
BALL::GAFFCESParser::CESPredicate
- addCESwildcardsConnectionPredicate() :
BALL::GAFFCESParser::CESPredicate
- addCESwildcardsPredicate() :
BALL::GAFFCESParser::CESPredicate
- addChild() :
BALL::ConnectedToPredicate::CTPNode
- addCoefficient() :
BALL::GAMESSLogFile
- addComponent() :
BALL::ComposedEnergyProcessor
- addComposite() :
BALL::VIEW::MolecularControl
- addComposite_() :
BALL::VIEW::MolecularStructure
- addDataItem() :
BALL::CIFFile::SaveFrame
- addDataPath() :
BALL::Path
- AddDV3_() :
BALL::MMFF94OutOfPlaneBend ,
BALL::MMFF94StretchBend ,
BALL::MMFF94Torsion
- ADDED__ATOM :
BALL::VIEW::EditableScene::EditOperation
- ADDED__BOND :
BALL::VIEW::EditableScene::EditOperation
- addEdge() :
BALL::SmartsParser
- addEditOperation() :
BALL::VIEW::EditOperationDialog
- addEmptyRow() :
BALL::VIEW::HotkeyTable
- addEntry() :
BALL::QSAR::Registry
- addGlWindow() :
BALL::VIEW::Scene
- addHydrogen_() :
BALL::AddHydrogenProcessor
- AddHydrogenProcessor() :
BALL::AddHydrogenProcessor
- addHydrogens() :
BALL::VIEW::MolecularStructure
- addItem_() :
BALL::VIEW::GeometricControl
- Addition() :
BALL::Addition< First, Second, DataType >
- additional_grid_distance_ :
BALL::VIEW::ColorProcessor
- AdditionalAtomInfo() :
BALL::PDB::AdditionalAtomInfo
- addLambda() :
BALL::QSAR::Model
- addLightPressed() :
BALL::VIEW::LightSettings
- addLightSource() :
BALL::VIEW::Stage
- AddLineModel() :
BALL::VIEW::AddLineModel
- addMissingHydrogens() :
BALL::SmilesParser
- addModel_() :
BALL::VIEW::RaytraceableContourSurfaceDialog
- addModularWidget() :
BALL::VIEW::MainControl
- addMonomericPolymer() :
BALL::NMRStarFile
- addMovable_() :
BALL::ResidueRotamerSet
- addNeededObjects_() :
BALL::PersistenceManager
- addNewAND() :
BALL::GAFFCESParser::CESPredicate
- addNewFragment_() :
BALL::FragmentDB
- addNewOR() :
BALL::GAFFCESParser::CESPredicate
- addNode() :
BALL::SmartsParser
- addPair() :
BALL::CIFFile::Item
- addPluginDirectory() :
BALL::PluginManager ,
BALL::VIEW::PluginDialog
- addPointerPair_() :
BALL::PersistenceManager
- addPropertiesFromSPAtom() :
BALL::SmartsParser::SPAtom
- addRecursiveEdge() :
BALL::SmartsParser
- addRepresentation() :
BALL::VIEW::GeometricControl
- addRingConnection() :
BALL::SmartsParser
- addRotamer() :
BALL::ResidueRotamerSet ,
BALL::RotamerLibrary
- addRow() :
BALL::VIEW::GenericControl
- addScoring() :
BALL::DockResult
- addScoringFunction() :
BALL::VIEW::DockDialog ,
BALL::VIEW::DockResultDialog
- addSolutionToStructures() :
BALL::VIEW::AssignBondOrderResultsDialog
- addSolvent() :
BALL::PeriodicBoundary
- addSPEdge() :
BALL::SmartsParser::SPNode
- addSphere_s_() :
BALL::BindingPocketProcessor
- addStructure() :
BALL::VIEW::EditableScene
- addStructure_() :
BALL::VIEW::EditableScene
- AddSurfaceModel() :
BALL::VIEW::AddSurfaceModel
- addTag() :
BALL::CIFFile::Item ,
BALL::VIEW::LabelDialog
- addToolBarEntries() :
BALL::VIEW::ModularWidget ,
BALL::VIEW::EditableScene ,
BALL::VIEW::Scene
- addTriangles_() :
BALL::TContourSurface< T >
- addTruePredicate() :
BALL::GAFFCESParser::CESPredicate
- addValue() :
BALL::CIFFile::Item
- AddVanDerWaalsModel() :
BALL::VIEW::AddVanDerWaalsModel
- addVariants() :
BALL::Enumerator< Container, SiteIterator, Variant
>
- ADENINE :
BALL::DNAMutator
- adjacent_edges_ :
BALL::NodeItem< Node, Edge >
- advanced_options_modified_ :
BALL::VIEW::DisplayProperties
- advancedClicked() :
BALL::VIEW::DockResultDialog
- advancedOptions() :
BALL::VIEW::MinimizationDialog ,
BALL::VIEW::MolecularDynamicsDialog
- after() :
BALL::String
- Ag :
BALL::Element
- ai :
BALL::MMFF94VDWParameters::VDWEntry
- Aij_ :
BALL::LennardJones
- Al :
BALL::Element
- AL :
BALL::SmilesParser
- ala_pressed() :
BALL::VIEW::PeptideDialog
- alg_ :
BALL::VIEW::DockProgressDialog
- algAdvancedPressed() :
BALL::VIEW::DockDialog
- Algorithm :
BALL::VIEW::DockingController
- ALGORITHM :
BALL::AssignBondOrderProcessor::Option ,
BALL::AssignBondOrderProcessor::Default
- ALGORITHM__DATABASE :
BALL::RotationalEntropyLoss
- ALGORITHM__GUESS :
BALL::RotationalEntropyLoss
- algorithm_dialogs_ :
BALL::VIEW::DockDialog
- ALGORITHM_NAME :
BALL::RingPerceptionProcessor::Option ,
BALL::RingPerceptionProcessor::Default
- algorithm_opt_ :
BALL::VIEW::DockDialog
- algorithm_type_ :
BALL::AmberNonBonded ,
BALL::CharmmNonBonded ,
BALL::MMFF94NonBonded ,
BALL::RotationalEntropyLoss
- algorithmChosen() :
BALL::VIEW::DockDialog
- AlgorithmType :
BALL::RotationalEntropyLoss
- ALIPHATIC :
BALL::SmartsParser::SPAtom
- all_amino_acids_ :
BALL::VIEW::PeptideDialog
- all_aromatic_atoms_ :
BALL::Kekuliser
- all_aromatic_rings_ :
BALL::CHPI
- ALL_ATOMS :
BALL::VIEW::LabelModel
- all_atoms_ :
BALL::SmilesParser
- all_CH_groups_ :
BALL::CHPI
- all_fragments_ :
BALL::FragmentDistanceCollector
- all_hydrogen_are_targets_ :
BALL::HaighMallionShiftProcessor
- ALL_ITEMS :
BALL::VIEW::LabelModel
- all_names_ :
BALL::VIEW::GLRenderer
- ALL_RESIDUES :
BALL::VIEW::LabelModel
- all_small_beers_ :
BALL::RingPerceptionProcessor
- all_small_rings_ :
BALL::RingPerceptionProcessor
- all_torsions_ :
BALL::ResidueTorsions
- allDiffEquations_ :
BALL::QSAR::FitModel
- allEquations_ :
BALL::QSAR::FitModel
- ALLModel() :
BALL::QSAR::ALLModel
- allowed_sf_ :
BALL::VIEW::DockDialog
- ALPHA :
BALL::VersionInfo ,
BALL::RegularExpression ,
BALL::PairExpInteractionEnergyProcessor::Option ,
BALL::PairExpInteractionEnergyProcessor::Default
- alpha :
BALL::PDB::RecordCRYST1::UnitCell ,
BALL::PDB::Structure::UnitCellInfo ,
BALL::AssignBondOrderProcessor::PQ_Entry_
- alpha_ :
BALL::CCP4File ,
BALL::DSN6File ,
BALL::LineSearch ,
BALL::PairExpInteractionEnergyProcessor ,
BALL::PairExpRDFIntegrator ,
BALL::AssignBondOrderProcessor ,
BALL::VIEW::ColorRGBA ,
BALL::CrystalInfo
- alpha_blending_ :
BALL::VIEW::ColorMap
- ALPHA_CHANNEL :
BALL::VIEW::ChannelFormat
- alpha_i :
BALL::MMFF94VDWParameters::VDWEntry
- alpha_proton_oxygen_hydrogen_separation_distance_ :
BALL::HBondShiftProcessor
- ALPHA_PROTON_OXYGEN_SEPARATION_DISTANCE :
BALL::HBondProcessor
- ALPHANUMERIC :
BALL::RegularExpression
- already_used_ :
BALL::HydrogenBond
- alreadySeenThisAtom() :
BALL::GAFFCESParser::CESPredicate
- alternate_location_indicator :
BALL::PDB::RecordANISOU ,
BALL::PDB::RecordATOM ,
BALL::PDB::RecordHETATM ,
BALL::PDB::RecordHYDBND::HydrogenPartnerAtom ,
BALL::PDB::RecordHYDBND::HydrogenAtom ,
BALL::PDB::RecordLINK::LinkPartner ,
BALL::PDB::RecordSIGATM ,
BALL::PDB::RecordSIGUIJ ,
BALL::PDB::RecordSLTBRG::PartnerAtom
- alternate_location_indicator_ :
BALL::PDBFile ,
BALL::PDBAtom
- ALUMINUM :
BALL::Element
- Am :
BALL::Element
- amber_ :
BALL::VIEW::AmberConfigurationDialog ,
BALL::VIEW::MolecularStructure
- amber_dialog_ :
BALL::VIEW::MinimizationDialog ,
BALL::VIEW::MolecularDynamicsDialog ,
BALL::VIEW::MolecularStructure
- AMBER_FF :
BALL::VIEW::DockingController ,
BALL::VIEW::MolecularStructure
- amber_ff_id_ :
BALL::VIEW::MolecularStructure
- AmberBend() :
BALL::AmberBend
- AmberConfigurationDialog() :
BALL::VIEW::AmberConfigurationDialog
- AmberEvaluation() :
BALL::AmberEvaluation
- AmberFF() :
BALL::AmberFF
- AmberNonBonded() :
BALL::AmberNonBonded
- AmberStretch() :
BALL::AmberStretch
- AmberTorsion() :
BALL::AmberTorsion
- AMBIENT :
BALL::VIEW::LightSource
- ambient_ :
BALL::VIEW::Stage
- ambient_color :
BALL::VIEW::Stage::RaytracingMaterial
- ambient_intensity :
BALL::VIEW::Stage::RaytracingMaterial
- ambientFactorChanged() :
BALL::VIEW::MaterialSettings
- ambiguity_code :
BALL::NMRStarFile::NMRAtomData ,
BALL::NMRAtomData
- AMERICIUM :
BALL::Element
- amide_proton_factor_ :
BALL::HBondShiftProcessor
- amide_proton_oxygen_hydrogen_separation_distance_ :
BALL::HBondShiftProcessor
- AMIDE_PROTON_OXYGEN_SEPARATION_DISTANCE :
BALL::HBondProcessor
- amide_proton_subtrahend_ :
BALL::HBondShiftProcessor
- amide_protons_are_targets_ :
BALL::HBondShiftProcessor
- AminoAcidDescriptor() :
BALL::Peptides::AminoAcidDescriptor
- analyticallyIntegrateInterval() :
BALL::Pair6_12RDFIntegrator
- ancestor_ :
BALL::Composite::AncestorIteratorTraits
- AncestorConstIterator :
BALL::Composite
- AncestorIterator :
BALL::Composite
- AncestorIteratorTraits :
BALL::Composite ,
BALL::Composite::AncestorIteratorTraits
- AND :
BALL::ExpressionTree ,
BALL::SmartsParser
- AND_LOW :
BALL::SmartsParser
- ang_num_ :
BALL::GeometricFit::RotationAngles_
- angle :
BALL::MMFF94Torsion::Torsion
- angle_ :
BALL::RSEdge ,
BALL::SASEdge ,
BALL::VIEW::LightSource
- angle_action_ :
BALL::VIEW::MolecularControl
- angle_changed() :
BALL::VIEW::PeptideDialog
- angle_measure :
BALL::PDB::RecordCISPEP
- ANGLE_TOLERANCE :
BALL::CHPI::Option ,
BALL::CHPI::Default
- angle_tolerance_ :
BALL::AromaticRingStacking ,
BALL::CHPI
- animate_() :
BALL::VIEW::Scene
- animateClicked() :
BALL::VIEW::SnapshotVisualisationDialog
- animation_export_PNG_action_ :
BALL::VIEW::Scene
- animation_export_POV_action_ :
BALL::VIEW::Scene
- animation_export_VRML_action_ :
BALL::VIEW::Scene
- animation_points_ :
BALL::VIEW::Scene
- animation_repeat_action_ :
BALL::VIEW::Scene
- animation_running_ :
BALL::VIEW::SnapshotVisualisationDialog
- animation_smoothness_ :
BALL::VIEW::Scene
- animation_thread_ :
BALL::VIEW::Scene
- animationSpeedChanged() :
BALL::VIEW::SnapshotVisualisationDialog
- AnimationThread :
BALL::VIEW::Scene ,
BALL::VIEW::AnimationThread
- anion :
BALL::MMFF94AtomTyper::AromaticType
- AnisotropyShiftProcessor() :
BALL::AnisotropyShiftProcessor
- annotateAliphaticAndAromaticRingAtoms_() :
BALL::GAFFTypeProcessor
- annotateBondTypes_() :
BALL::GAFFTypeProcessor
- annotatePlanarRingAtoms_() :
BALL::GAFFTypeProcessor
- annotateRingSizes_() :
BALL::GAFFTypeProcessor
- AntechamberFile() :
BALL::AntechamberFile
- ANTIMONY :
BALL::Element
- ANY :
BALL::SmartsParser::SPBond
- ANY_TYPE :
BALL::Atom
- ANY_ZE :
BALL::SmartsParser
- append() :
BALL::DCDFile ,
BALL::TrajectoryFile ,
BALL::TRRFile ,
BALL::AtomContainer ,
BALL::Chain ,
BALL::Molecule ,
BALL::Nucleotide ,
BALL::Residue ,
BALL::SecondaryStructure ,
BALL::System
- appendChild() :
BALL::Composite ,
BALL::ExpressionTree
- appendHotkey() :
BALL::VIEW::HotkeyTable
- appendIconPath() :
BALL::VIEW::IconLoader
- appendLine() :
BALL::INIFile
- appendSection() :
BALL::INIFile
- appendText() :
BALL::VIEW::PyWidget
- appendText_() :
BALL::VIEW::PyWidget
- appendToHistory_() :
BALL::VIEW::PyWidget
- applied() :
BALL::VIEW::Preferences
- apply() :
BALL::HashSet< Key > ,
BALL::VIEW::DisplayProperties ,
BALL::ResourceFile ,
BALL::Composite ,
BALL::TContour< T > ,
BALL::HashGridBox3< Item > ,
BALL::HashGrid3< Item > ,
BALL::List< Value > ,
BALL::INIFile ,
BALL::ResourceEntry , BALL::PTE_
,
BALL::ElectrostaticPotentialCalculator ,
BALL::AssignBondOrderProcessor ,
BALL::VIEW::LightSettings ,
BALL::VIEW::MaterialSettings ,
BALL::VIEW::StageSettings ,
BALL::VIEW::StereoSettingsDialog
- apply_() :
BALL::AssignBondOrderProcessor
- APPLY_FIRST_SOLUTION :
BALL::AssignBondOrderProcessor::Option ,
BALL::AssignBondOrderProcessor::Default
- apply_processor_ :
BALL::VIEW::AtomOverview
- applyAncestor() :
BALL::Composite
- applyBonds() :
BALL::Atom
- applyChild() :
BALL::Composite
- applyChildNostart_() :
BALL::Composite
- applyChildren() :
BALL::ResourceEntry ,
BALL::ResourceFile
- applyColoringSettings_() :
BALL::VIEW::DisplayProperties
- applyDescendant() :
BALL::Composite
- applyDescendantPostorder() :
BALL::Composite
- applyDescendantPostorderNostart_() :
BALL::Composite
- applyDescendantPreorder() :
BALL::Composite
- applyDescendantPreorderNostart_() :
BALL::Composite
- applyFirstSnapShot() :
BALL::SnapShotManager
- applyForceFieldSettings_() :
BALL::VIEW::MolecularStructure
- applyInterBond() :
BALL::AtomContainer
- applyIntraBond() :
BALL::AtomContainer
- applyLastSnapShot() :
BALL::SnapShotManager
- applyLevel() :
BALL::Composite
- applyLevelNostart_() :
BALL::Composite
- applyModelSettings_() :
BALL::VIEW::DisplayProperties
- applyNextSnapShot() :
BALL::SnapShotManager
- applyNostart_() :
BALL::ResourceEntry
- applyPostorder() :
BALL::Composite
- applyPreferences() :
BALL::VIEW::Preferences ,
BALL::VIEW::MainControl ,
BALL::VIEW::ModularWidget ,
BALL::VIEW::ServerWidget ,
BALL::VIEW::EditableScene ,
BALL::VIEW::PyWidget ,
BALL::VIEW::Scene ,
BALL::VIEW::DisplayProperties
- applyPreferencesClicked_() :
BALL::VIEW::MainControl
- applyPreorder() :
BALL::Composite
- applyPreorderNostart_() :
BALL::Composite
- ApplyProcessor() :
BALL::VIEW::AtomOverview::ApplyProcessor
- applyProcessors_() :
BALL::VIEW::DockDialog ,
BALL::VIEW::FDPBDialog
- applySelector() :
BALL::VIEW::MolecularControl
- applySettings() :
BALL::VIEW::NetworkPreferences
- applySettingsTo() :
BALL::VIEW::ColoringSettingsDialog ,
BALL::VIEW::ModelSettingsDialog
- applySnapshot() :
BALL::VIEW::SnapshotManagerInterface
- applySnapShot() :
BALL::SnapShot ,
BALL::SnapShotManager
- applySolution_() :
BALL::Kekuliser
- applySplit() :
BALL::VIEW::ModifyRepresentationDialog
- applyTo() :
BALL::VIEW::AmberConfigurationDialog ,
BALL::VIEW::CharmmConfigurationDialog ,
BALL::VIEW::MMFF94ConfigurationDialog
- applyTo_() :
BALL::VIEW::DisplayProperties
- applyValues_() :
BALL::VIEW::DockDialog ,
BALL::VIEW::FDPBDialog
- aps_matcher :
BALL::GAFFCESParser::CESPredicate
- aps_terms :
BALL::GAFFCESParser::APSMatcher
- APS_TRUE :
BALL::GAFFCESParser::APSMatcher
- APSMatcher() :
BALL::GAFFCESParser::APSMatcher
- APSTerm() :
BALL::GAFFCESParser::APSMatcher::APSTerm
- APSType :
BALL::GAFFCESParser::APSMatcher
- Ar :
BALL::Element
- areInOneAromaticRing() :
BALL::MMFF94
- areInOneRing() :
BALL::MMFF94
- arg_pressed() :
BALL::VIEW::PeptideDialog
- ARGENTUM :
BALL::Element
- ARGON :
BALL::Element
- argument :
BALL::ExpressionParser::SyntaxTree
- argument_ :
BALL::ExpressionPredicate
- argument_pointer :
BALL::UnaryFunctor< ArgumentType, ResultType >
- argument_reference :
BALL::UnaryFunctor< ArgumentType, ResultType >
- argument_type :
BALL::UnaryFunctor< ArgumentType, ResultType >
- arom :
BALL::MMFF94AtomType
- arom_proc_ :
BALL::SMARTSPredicate
- aromat_list_ :
BALL::JohnsonBoveyShiftProcessor
- AROMATIC :
BALL::SmartsParser::SPBond ,
BALL::SmartsParser::SPAtom
- aromatic_atoms_ :
BALL::Kekuliser
- AROMATIC_BOND :
BALL::GAFFCESParser::APSMatcher
- AROMATIC_BOND_TO_PARENT :
BALL::GAFFCESParser::APSMatcher
- aromatic_bonds_ :
BALL::MMFF94
- aromatic_color_ :
BALL::VIEW::ResidueTypeColorProcessor
- aromatic_rings_ :
BALL::MMFF94 ,
BALL::MMFF94ChargeProcessor ,
BALL::Kekuliser ,
BALL::AtomTyper
- aromatic_systems_ :
BALL::Kekuliser
- aromatic_types_5_map_ :
BALL::MMFF94AtomTyper
- AromaticityProcessor() :
BALL::AromaticityProcessor
- AromaticRing() :
BALL::CHPI::AromaticRing
- AromaticRingStacking() :
BALL::AromaticRingStacking
- aromatize() :
BALL::AromaticityProcessor
- aromatizeSimple() :
BALL::AromaticityProcessor
- arrangeBonds_() :
BALL::Bond
- ARRAY :
BALL::JCAMPFile
- arrow_width_ :
BALL::VIEW::AddCartoonModel
- ARSENIC :
BALL::Element
- As :
BALL::Element
- asn_pressed() :
BALL::VIEW::PeptideDialog
- asp_pressed() :
BALL::VIEW::PeptideDialog
- ASP_SEPERATION :
BALL::BindingPocketProcessor::Option ,
BALL::BindingPocketProcessor::Default
- aspec :
BALL::MMFF94AtomType
- asps_ :
BALL::BindingPocketProcessor
- ASSEMBLED :
BALL::SDGenerator
- assembleSD_() :
BALL::SDGenerator
- assign() :
BALL::Templates
- assign_bond_orders_id_ :
BALL::VIEW::MolecularStructure
- ASSIGN_CHARGES :
BALL::AmberFF::Option ,
BALL::AmberFF::Default ,
BALL::CharmmFF::Option ,
BALL::MMFF94::Option ,
BALL::MMFF94::Default ,
BALL::CharmmFF::Default
- assign_charges_id_ :
BALL::VIEW::MolecularStructure
- ASSIGN_TYPENAMES :
BALL::AmberFF::Default ,
BALL::CharmmFF::Option ,
BALL::CharmmFF::Default ,
BALL::MMFF94::Default ,
BALL::MMFF94::Option ,
BALL::AmberFF::Option
- ASSIGN_TYPES :
BALL::MMFF94::Default ,
BALL::CharmmFF::Option ,
BALL::AmberFF::Default ,
BALL::AmberFF::Option ,
BALL::CharmmFF::Default ,
BALL::MMFF94::Option
- assignAromaticType_5_() :
BALL::MMFF94AtomTyper
- assignAtomtype_() :
BALL::GAFFTypeProcessor
- assignBackboneAtoms() :
BALL::AtomBijection
- AssignBaseProcessor() :
BALL::AssignBaseProcessor
- AssignBondOrderConfigurationDialog() :
BALL::VIEW::AssignBondOrderConfigurationDialog
- AssignBondOrderProcessor() :
BALL::AssignBondOrderProcessor ,
BALL::AssignBondOrderProcessor::Solution_ ,
BALL::AssignBondOrderProcessor::PQ_Entry_ ,
BALL::AssignBondOrderProcessor
- AssignBondOrderResultsDialog() :
BALL::VIEW::AssignBondOrderResultsDialog
- assignBondTypes_() :
BALL::MMFF94
- assignByName() :
BALL::AtomBijection
- assignCAlphaAtoms() :
BALL::AtomBijection
- AssignChargeProcessor() :
BALL::AssignChargeProcessor
- assignCharges() :
BALL::Templates
- assignFormalCharge() :
BALL::MMFF94ChargeProcessor
- ASSIGNMENT__ELDRIDGE :
BALL::FresnoTypes
- ASSIGNMENT__FRESNO :
BALL::FresnoTypes
- assignMMFF94BondType() :
BALL::MMFF94
- assignModelType() :
BALL::VIEW::AddCartoonModel ,
BALL::VIEW::AddBackboneModel
- assignNucleotideAtoms_() :
BALL::VIEW::AddCartoonModel
- assignParameters() :
BALL::QuadraticImproperTorsion ,
BALL::QuadraticBondStretch ,
BALL::MMFF94PlaneParameters ,
BALL::MMFF94TorsionParameters ,
BALL::MMFF94StretchParameters ,
BALL::MMFF94StretchBendParameters ,
BALL::CharmmEEF1 ,
BALL::LennardJones ,
BALL::QuadraticAngleBend ,
BALL::MMFF94BendParameters ,
BALL::MMFF94VDWParameters ,
BALL::Potential1210 ,
BALL::CosineTorsion
- assignPartialCharges_() :
BALL::MMFF94ChargeProcessor
- AssignRadiusProcessor() :
BALL::AssignRadiusProcessor
- assignRTD_() :
BALL::RingAnalyser
- assignShifts() :
BALL::NMRStarFile
- assignShifts_() :
BALL::NMRStarFile
- assignSpecificValues_() :
BALL::AtomTyper
- assignTo() :
BALL::AtomTyper ,
BALL::MMFF94AtomTyper ,
BALL::AtomTyper
- assignTorsion() :
BALL::ResidueTorsions
- assignTrivial() :
BALL::AtomBijection
- AssignTypeNameProcessor() :
BALL::AssignTypeNameProcessor
- assignTypeNames() :
BALL::Templates
- AssignTypeProcessor() :
BALL::AssignTypeProcessor
- ASTATINE :
BALL::Element
- ASU :
BALL::CrystalGenerator
- asu_ :
BALL::CrystalGenerator
- At :
BALL::Element
- at() :
BALL::PDBRecords
- ATIJK :
BALL::MMFF94StretchBend::Bend
- Atom :
BALL::Bond ,
BALL::Atom
- atom :
BALL::PDB::Structure::AtomEntry ,
BALL::FragmentDB::BuildBondsProcessor::Connection ,
BALL::CharmmEEF1::Data
- Atom() :
BALL::Atom
- atom :
BALL::VIEW::EditableScene::EditOperation ,
BALL::Kekuliser::AtomInfo
- Atom() :
BALL::Atom
- atom1 :
BALL::MMFF94StretchBend::Bend ,
BALL::AmberTorsion::SingleAmberTorsion ,
BALL::CharmmTorsion::SingleCharmmTorsion ,
BALL::MMFF94Torsion::Torsion ,
BALL::Potential1210::Data ,
BALL::QuadraticBondStretch::Data ,
BALL::CosineTorsion::SingleData ,
BALL::LennardJones::Data ,
BALL::MOL2File::BondStruct ,
BALL::QuadraticAngleBend::Data ,
BALL::QuadraticImproperTorsion::Data ,
BALL::CosineTorsion::Data ,
BALL::MMFF94StretchBend::Stretch
- atom2 :
BALL::QuadraticAngleBend::Data ,
BALL::Potential1210::Data ,
BALL::MOL2File::BondStruct ,
BALL::MMFF94StretchBend::Stretch ,
BALL::MMFF94Torsion::Torsion ,
BALL::CosineTorsion::Data ,
BALL::LennardJones::Data ,
BALL::QuadraticImproperTorsion::Data ,
BALL::QuadraticBondStretch::Data ,
BALL::CosineTorsion::SingleData ,
BALL::AmberTorsion::SingleAmberTorsion ,
BALL::CharmmTorsion::SingleCharmmTorsion ,
BALL::MMFF94StretchBend::Bend
- atom3 :
BALL::CharmmTorsion::SingleCharmmTorsion ,
BALL::MMFF94Torsion::Torsion ,
BALL::QuadraticImproperTorsion::Data ,
BALL::CosineTorsion::Data ,
BALL::CosineTorsion::SingleData ,
BALL::QuadraticAngleBend::Data ,
BALL::AmberTorsion::SingleAmberTorsion ,
BALL::MMFF94StretchBend::Bend
- atom4 :
BALL::CosineTorsion::SingleData ,
BALL::CharmmTorsion::SingleCharmmTorsion ,
BALL::QuadraticImproperTorsion::Data ,
BALL::AmberTorsion::SingleAmberTorsion ,
BALL::CosineTorsion::Data ,
BALL::MMFF94Torsion::Torsion
- atom_ :
BALL::NodeItem< Node, Edge > ,
BALL::RSVertex ,
BALL::SmartsParser::SPAtom ,
BALL::VIEW::BondProperties ,
BALL::ReducedSurface ,
BALL::SESVertex ,
BALL::Peak< PositionType >
- atom_2_distance_ :
BALL::VIEW::AtomDistanceColorProcessor
- atom_areas_ :
BALL::NumericalSAS
- atom_array :
BALL::FDPB
- atom_data :
BALL::NMRAtomDataSet ,
BALL::NMRStarFile::NMRAtomDataSet
- atom_data_sets_ :
BALL::NMRStarFile
- atom_distance_ :
BALL::VIEW::FieldLineCreator
- ATOM_EXACT_CHANGE :
BALL::MOLFile::Property
- atom_forces_ :
BALL::SnapShot
- atom_format_ :
BALL::MOLFile
- atom_grid_ :
BALL::VIEW::ColorProcessor
- ATOM_GROUP :
BALL::NMRStarFile
- atom_group :
BALL::ShiftReferenceElement ,
BALL::NMRStarFile::ShiftReferenceElement
- ATOM_H0_DESIGNATOR :
BALL::MOLFile::Property
- ATOM_HYDROGEN_COUNT :
BALL::MOLFile::Property
- atom_ID :
BALL::NMRAtomData ,
BALL::NMRStarFile::NMRAtomData
- atom_infos_ :
BALL::Kekuliser
- ATOM_INVERSION_RETENTION :
BALL::MOLFile::Property
- atom_list_ :
BALL::JohnsonBoveyShiftProcessor
- atom_map_ :
BALL::PDBFile
- ATOM_MASS_DIFFERENCE :
BALL::MOLFile::Property
- atom_name :
BALL::NMRAtomData ,
BALL::NMRStarFile::NMRAtomData ,
BALL::PDB::RecordHYDBND::HydrogenAtom ,
BALL::PDB::RecordHYDBND::HydrogenPartnerAtom ,
BALL::PDB::RecordHETATM ,
BALL::PDB::RecordANISOU ,
BALL::PDB::RecordLINK::LinkPartner ,
BALL::PDB::RecordSIGUIJ ,
BALL::PDB::RecordSLTBRG::PartnerAtom ,
BALL::PDB::RecordSIGATM ,
BALL::PDB::RecordATOM
- atom_name_A :
BALL::ResidueTorsions::Data
- atom_name_B :
BALL::ResidueTorsions::Data
- atom_name_C :
BALL::ResidueTorsions::Data
- atom_name_D :
BALL::ResidueTorsions::Data
- atom_name_in_current_strand :
BALL::PDB::RecordSHEET
- atom_name_in_previous_strand :
BALL::PDB::RecordSHEET
- atom_names :
BALL::JohnsonBoveyShiftProcessor::Ring
- atom_nr_ :
BALL::AddHydrogenProcessor
- atom_number_ :
BALL::VIEW::EditableScene
- atom_overview_ :
BALL::VIEW::MolecularControl
- atom_overview_selection_ :
BALL::VIEW::MolecularControl
- atom_pair_vector_ :
BALL::MMFF94NonBonded
- atom_pos_ :
BALL::VIEW::EditableScene
- atom_positions_ :
BALL::SnapShot
- ATOM_REACTION_COMPONENT_NUMBER :
BALL::MOLFile::Property
- ATOM_REACTION_COMPONENT_TYPE :
BALL::MOLFile::Property
- atom_serial_number :
BALL::PDB::RecordCONECT
- atom_set_ :
BALL::VIEW::AtomBondModelBaseProcessor
- atom_status_ :
BALL::RSComputer
- ATOM_STEREO_CARE_BOX :
BALL::MOLFile::Property
- atom_surface_map_ :
BALL::NumericalSAS
- atom_surfaces_ :
BALL::NumericalSAS
- atom_to_block_ :
BALL::AssignBondOrderProcessor
- atom_to_node_ :
BALL::TMolecularGraph< Node, Edge >
- atom_to_test :
BALL::GAFFCESParser::CESPredicate
- atom_to_tnode_ :
BALL::RingPerceptionProcessor
- atom_to_virtual_bond_index_ :
BALL::AssignBondOrderProcessor
- atom_type :
BALL::NMRStarFile::NMRAtomData ,
BALL::GAFFTypeProcessor::TypeDefinition
- ATOM_TYPE :
BALL::NMRStarFile
- atom_type :
BALL::NMRStarFile::ShiftReferenceElement ,
BALL::NMRAtomData ,
BALL::NMRStarFile::ShiftReferenceElement ,
BALL::ShiftReferenceElement
- ATOM_TYPE_FF_FILENAME :
BALL::HybridisationProcessor::Option ,
BALL::HybridisationProcessor::Default
- ATOM_TYPE_FILE :
BALL::NonpolarSolvation::Option ,
BALL::NonpolarSolvation::Default
- atom_type_normalization_factor :
BALL::AssignBondOrderProcessor::PQ_Entry_
- atom_type_normalization_factor_ :
BALL::AssignBondOrderProcessor
- atom_type_penalty :
BALL::AssignBondOrderProcessor::Solution_
- atom_type_smarts_ :
BALL::HybridisationProcessor
- ATOM_TYPE_SMARTS_FILENAME :
BALL::HybridisationProcessor::Option ,
BALL::HybridisationProcessor::Default
- atom_typer_ :
BALL::MMFF94
- atom_types_ :
BALL::MMFF94 ,
BALL::AssignTypeProcessor ,
BALL::ForceFieldParameters ,
BALL::MMFF94AtomTyper ,
BALL::GAFFTypeProcessor ,
BALL::SolventParameter
- ATOM_VALENCE :
BALL::MOLFile::Property
- atom_vector_ :
BALL::MolecularDynamics
- atom_velocities_ :
BALL::SnapShot
- atom_volumes_ :
BALL::NumericalSAS
- AtomBijection() :
BALL::AtomBijection
- AtomBondModelBaseProcessor() :
BALL::VIEW::AtomBondModelBaseProcessor
- AtomBox :
BALL::VIEW::ModifyRepresentationDialog ,
BALL::VIEW::ColorProcessor
- AtomChargeColorProcessor() :
BALL::VIEW::AtomChargeColorProcessor
- AtomContainer() :
BALL::AtomContainer
- AtomContainerIteratorTraits() :
BALL::AtomContainerIteratorTraits
- AtomDistanceColorProcessor() :
BALL::VIEW::AtomDistanceColorProcessor
- AtomDistanceHashMap :
BALL::VIEW::AtomDistanceColorProcessor
- AtomEntry() :
BALL::PDB::Structure::AtomEntry
- AtomGrid :
BALL::VIEW::ColorProcessor ,
BALL::VIEW::ModifyRepresentationDialog
- atomic_coordinate_records :
BALL::PDB::BookKeeping
- atomic_number :
BALL::MMFF94AtomTyper::AromaticType ,
BALL::GAFFTypeProcessor::TypeDefinition
- atomic_number_ : BALL::Element
,
BALL::VIEW::EditableScene
- atomic_number_to_element_ : BALL::PTE_
- atomic_property :
BALL::GAFFTypeProcessor::TypeDefinition
- atomic_radius_ : BALL::Element
- atomic_weight_ : BALL::Element
- AtomicNumber : BALL::Element
- AtomicPolarizabilities() :
BALL::AtomicPolarizabilities
- AtomIndexArray :
BALL::PeriodicBoundary
- AtomIndexList :
BALL::Atom
- AtomIndexMap :
BALL::KCFFile
- AtomIndexPair :
BALL::PeriodicBoundary
- AtomInformationContent() :
BALL::AtomInformationContent
- AtomIteratorTraits() :
BALL::AtomIteratorTraits
- AtomOverview() :
BALL::VIEW::AtomOverview
- AtomPair :
BALL::AtomBijection
- atomProperties_() :
BALL::VIEW::PTEDialog ,
BALL::VIEW::EditableScene
- AtomPtrList :
BALL::Atom
- atoms :
BALL::RingAnalyser::Ring ,
BALL::PDB::Structure
- atoms_ :
BALL::GeneralizedBornModel ,
BALL::MMFF94ChargeProcessor ,
BALL::ForceField ,
BALL::AtomTyper ,
BALL::MOL2File ,
BALL::VIEW::AddSurfaceModel
- atoms_to_delete :
BALL::AssignBondOrderProcessor::Solution_
- AtomStatus :
BALL::RSComputer
- ATOMTYPE_FILENAME :
BALL::GAFFTypeProcessor::Option ,
BALL::GAFFTypeProcessor::Default
- AtomTyper() :
BALL::AtomTyper
- AtomTypes() :
BALL::AtomTypes
- AtomVector() :
BALL::AtomVector
- attachBridged_() :
BALL::SDGenerator
- attachCore_() :
BALL::SDGenerator
- attached_hydrogens :
BALL::GAFFTypeProcessor::TypeDefinition
- attachFused_() :
BALL::SDGenerator
- attachSpiro_() :
BALL::SDGenerator
- attachTemplate_() :
BALL::SDGenerator
- attenuation_ :
BALL::VIEW::LightSource
- Au :
BALL::Element
- AURUM :
BALL::Element
- authors :
BALL::PDB::RecordAUTHOR
- AutoDeletable() :
BALL::AutoDeletable
- autoScale() :
BALL::VIEW::GridVisualizationDialog ,
BALL::VIEW::ModifyRepresentationDialog
- autoScaleRequested() :
BALL::VIEW::GridColorWidget
- average_ :
BALL::EmpiricalHSShiftProcessor::ShiftHyperSurface_
- AVERAGE_SECTION_NAME :
BALL::CreateSpectrumProcessor
- AverageBondAngle_() :
BALL::HybridisationProcessor
- averaging_ :
BALL::PolarSolvation
- AVERAGING__NONE :
BALL::PolarSolvation
- AVERAGING__RANDOM :
BALL::PolarSolvation
- AVERAGING__RANDOM_FACTOR :
BALL::PolarSolvation
- AVERAGING__STATIC :
BALL::PolarSolvation
- AveragingMethod :
BALL::PolarSolvation
- AVOGADRO :
BALL::Constant
- axis_color_ :
BALL::VIEW::RegularData2DWidget ,
BALL::VIEW::RegularData1DWidget