Here is a list of all documented functions with links to the class documentation for each member:
- g -
- GaussianTriangleQuadratureRule() : OpenMD::GaussianTriangleQuadratureRule
- GBheadVisitor() : OpenMD::GBheadVisitor
- GBtailVisitor() : OpenMD::GBtailVisitor
- get() : OpenMD::OpenMDBitSet, OpenMD::SelectionSet
- get95percentConfidenceInterval() : OpenMD::Accumulator, OpenMD::MatrixAccumulator, OpenMD::PotVecAccumulator, OpenMD::VectorAccumulator
- get_rotation_angle() : OpenMD::Quaternion< Real >
- getA() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- GetAllredRochowElectroNeg() : OpenMD::Element, OpenMD::ElementsTable
- getAllTokens() : OpenMD::StringTokenizer
- getAngularMomentum() : OpenMD::Thermo
- getArray() : OpenMD::DynamicRectMatrix< Real >, OpenMD::RectMatrix< Real, Row, Col >, OpenMD::Vector< Real, Dim >
- getArrayPointer() : OpenMD::DataStorage, OpenMD::RectMatrix< Real, Row, Col >, OpenMD::Vector< Real, Dim >
- getAST() : antlr::Parser, antlr::TreeParser
- getASTFactory() : antlr::Parser, antlr::TreeParser
- getASTNodeType() : antlr::ASTFactory
- GetAtomicNum() : OpenMD::Element, OpenMD::ElementsTable
- getAtomPos() : OpenMD::RigidBody
- getAtomRefCoor() : OpenMD::RigidBody
- getAtoms() : OpenMD::RigidBody
- getAtomsInGroupRow() : OpenMD::ForceMatrixDecomposition
- getAtomStorageLayout() : OpenMD::SimInfo
- getAtomType() : OpenMD::Atom, OpenMD::ForceField
- getAtomVel() : OpenMD::RigidBody
- getAverage() : OpenMD::Accumulator, OpenMD::MatrixAccumulator, OpenMD::PotVecAccumulator, OpenMD::VectorAccumulator
- getAverageLength() : OpenMD::PotVecAccumulator, OpenMD::VectorAccumulator
- GetBlue() : OpenMD::Element
- getBoundingBox() : OpenMD::Snapshot, OpenMD::Thermo
- getBytesPerStuntDouble() : OpenMD::DataStorage
- getChar() : antlr::CharBuffer, antlr::CharInputBuffer, antlr::InputBuffer
- getChebyshevPolynomial() : OpenMD::ChebyshevT, OpenMD::ChebyshevU
- getCoefficient() : OpenMD::Polynomial< Real >
- getColumn() : antlr::CharScanner, antlr::CommonToken, antlr::RecognitionException, OpenMD::DynamicRectMatrix< Real >, OpenMD::RectMatrix< Real, Row, Col >
- getCOM() : OpenMD::StuntDouble
- getCom() : OpenMD::Molecule, OpenMD::Thermo
- getComAll() : OpenMD::Thermo
- getCOMvel() : OpenMD::StuntDouble
- getComVel() : OpenMD::Molecule, OpenMD::Thermo
- getCOMw() : OpenMD::StuntDouble
- getConsElem1() : OpenMD::ConstraintPair
- getConsElem2() : OpenMD::ConstraintPair
- getContactValueAt() : OpenMD::ShapeAtomType
- GetCovalentRad() : OpenMD::Element, OpenMD::ElementsTable
- getCurrentSnapshot() : OpenMD::SnapshotManager
- getCurrentStream() : antlr::TokenStreamSelector
- getD() : JAMA::Eigenvalue< Real >
- getData() : OpenMD::SimpleTypeData< ElemDataType >
- getDelimiters() : OpenMD::StringTokenizer
- getDensity() : OpenMD::StuntDouble
- getDerivative() : OpenMD::Polynomial< Real >
- getDipole() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getEigenvalues() : OpenMD::RealSymmetricTridiagonal< Real >
- getEigenvectors() : OpenMD::RealSymmetricTridiagonal< Real >
- getElectricField() : OpenMD::StuntDouble
- GetElectronAffinity() : OpenMD::Element, OpenMD::ElementsTable
- GetElectroNeg() : OpenMD::Element, OpenMD::ElementsTable
- getEuler() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getFileLineColumnString() : antlr::RecognitionException
- getFilename() : antlr::CharScanner, antlr::Parser, antlr::RecognitionException
- getFirstChild() : antlr::AST, antlr::ASTNULLType, antlr::BaseAST
- getFlucQFrc() : OpenMD::StuntDouble
- getFlucQPos() : OpenMD::StuntDouble
- getFlucQVel() : OpenMD::StuntDouble
- getForceField() : OpenMD::SimInfo
- getFrameDataSize() : OpenMD::Snapshot
- getFrc() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getGlobalAtomIndices() : OpenMD::SimInfo
- getGlobalCountOfType() : OpenMD::SimInfo
- getGlobalGroupIndices() : OpenMD::SimInfo
- getGlobalIndex() : OpenMD::ConstraintElem, OpenMD::Molecule, OpenMD::ShortRangeInteraction, OpenMD::StuntDouble
- getGrad() : OpenMD::Atom, OpenMD::ConstraintElem, OpenMD::DirectionalAtom, OpenMD::RigidBody, OpenMD::StuntDouble
- GetGreen() : OpenMD::Element
- getGyrationalVolume() : OpenMD::Thermo
- getHiddenAfter() : antlr::TokenStreamHiddenTokenFilter
- getHiddenBefore() : antlr::TokenStreamHiddenTokenFilter
- getHmat() : OpenMD::Snapshot
- getHouseholder() : JAMA::QR< Real >
- getHybridization() : OpenMD::Atom
- getI() : OpenMD::Atom, OpenMD::ConstraintElem, OpenMD::DirectionalAtom, OpenMD::RigidBody, OpenMD::StuntDouble
- getID() : OpenMD::GenericData, OpenMD::Snapshot
- getIdents() : OpenMD::GenericFactory< Object, IdentType, Creator >, OpenMD::HydrodynamicsModelFactory, OpenMD::IntegratorFactory, OpenMD::LatticeFactory, OpenMD::OptimizationFactory
- getImagEigenvalues() : JAMA::Eigenvalue< Real >
- getInertiaTensor() : OpenMD::Thermo
- getInitialHiddenToken() : antlr::TokenStreamHiddenTokenFilter
- getInstance() : OpenMD::GenericFactory< Object, IdentType, Creator >, OpenMD::HydrodynamicsModelFactory, OpenMD::IntegratorFactory, OpenMD::LatticeFactory, OpenMD::OptimizationFactory
- getInvBoundingBox() : OpenMD::Snapshot
- getInvHmat() : OpenMD::Snapshot
- getIOIndexToIntegrableObject() : OpenMD::SimInfo
- GetIonization() : OpenMD::Element, OpenMD::ElementsTable
- getJ() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getLAChars() : antlr::InputBuffer
- getLastRewriteTokenIndex() : antlr::TokenStreamRewriteEngine
- getLastValue() : OpenMD::Accumulator, OpenMD::MatrixAccumulator, OpenMD::PotVecAccumulator, OpenMD::VectorAccumulator
- getLegendrePolynomial() : OpenMD::LegendrePolynomial
- getLength95percentConfidenceInterval() : OpenMD::PotVecAccumulator, OpenMD::VectorAccumulator
- getLengthStdDev() : OpenMD::PotVecAccumulator, OpenMD::VectorAccumulator
- getLengthVariance() : OpenMD::PotVecAccumulator, OpenMD::VectorAccumulator
- getLine() : antlr::CharScanner, antlr::CommonToken, antlr::RecognitionException
- getLocalIndex() : OpenMD::ConstraintElem, OpenMD::CutoffGroup, OpenMD::ShortRangeInteraction, OpenMD::StuntDouble
- getLocalIndexManager() : OpenMD::SimInfo
- getMarkedChars() : antlr::InputBuffer
- GetMass() : OpenMD::Element, OpenMD::ElementsTable
- getMass() : OpenMD::ConstraintElem, OpenMD::Molecule, OpenMD::StuntDouble
- getMax() : OpenMD::Accumulator
- GetMaxBonds() : OpenMD::Element, OpenMD::ElementsTable
- getMaxLength() : OpenMD::PotVecAccumulator, OpenMD::VectorAccumulator
- getMessage() : antlr::ANTLRException, antlr::MismatchedCharException, antlr::MismatchedTokenException, antlr::NoViableAltException, antlr::NoViableAltForCharException
- getMin() : OpenMD::Accumulator
- getMinLength() : OpenMD::PotVecAccumulator, OpenMD::VectorAccumulator
- getMoleculeByGlobalIndex() : OpenMD::SimInfo
- getMoleculeStamp() : OpenMD::SimInfo
- getMolToProc() : OpenMD::SimInfo
- GetName() : OpenMD::Element, OpenMD::ElementsTable
- getName() : OpenMD::Bend, OpenMD::Bond, OpenMD::Inversion, OpenMD::ShortRangeInteraction, OpenMD::Torsion
- getNAtoms() : OpenMD::Molecule, OpenMD::SimInfo
- getNBends() : OpenMD::Molecule, OpenMD::SimInfo
- getNBlocks() : OpenMD::BlockSnapshotManager
- getNBonds() : OpenMD::Molecule, OpenMD::SimInfo
- getNConstraintPairs() : OpenMD::Molecule
- getNConstraints() : OpenMD::SimInfo
- getNCutoffGroups() : OpenMD::Molecule, OpenMD::SimInfo
- getNdf() : OpenMD::SimInfo
- getNdfLocal() : OpenMD::SimInfo
- getNdfRaw() : OpenMD::SimInfo
- getNdfTrans() : OpenMD::SimInfo
- getNextSibling() : antlr::AST, antlr::ASTNULLType, antlr::BaseAST
- getNFluctuatingCharges() : OpenMD::Molecule, OpenMD::SimInfo
- getNFrames() : OpenMD::DumpReader
- getNGlobalAtoms() : OpenMD::SimInfo
- getNGlobalBends() : OpenMD::SimInfo
- getNGlobalBonds() : OpenMD::SimInfo
- getNGlobalCutoffGroups() : OpenMD::SimInfo
- getNGlobalIntegrableObjects() : OpenMD::SimInfo
- getNGlobalInversions() : OpenMD::SimInfo
- getNGlobalMolecules() : OpenMD::SimInfo
- getNGlobalRigidBodies() : OpenMD::SimInfo
- getNGlobalTorsions() : OpenMD::SimInfo
- getNHBondAcceptors() : OpenMD::Molecule
- getNHBondDonors() : OpenMD::Molecule
- getNIntegrableObjects() : OpenMD::Molecule, OpenMD::SimInfo
- getNInversions() : OpenMD::Molecule, OpenMD::SimInfo
- getNLocalCutoffGroups() : OpenMD::SimInfo
- getNMolecules() : OpenMD::SimInfo
- getNMoleculeStamp() : OpenMD::SimInfo
- getNpoints() : OpenMD::Icosahedron
- getNRigidBodies() : OpenMD::Molecule, OpenMD::SimInfo
- getNTorsions() : OpenMD::Molecule, OpenMD::SimInfo
- getNumAtoms() : OpenMD::RigidBody
- getNumberOfAtoms() : OpenMD::Snapshot
- getNumberOfChildren() : antlr::AST, antlr::ASTNULLType, antlr::BaseAST
- getNumberOfCutoffGroups() : OpenMD::Snapshot
- GetNumberOfElements() : OpenMD::ElementsTable
- getNumberOfRigidBodies() : OpenMD::Snapshot
- getNumTokens() : antlr::Parser, antlr::TreeParser
- getNZconstraint() : OpenMD::SimInfo
- getOriginal() : OpenMD::StringTokenizer
- getPairList() : OpenMD::PairList
- getParticlePot() : OpenMD::StuntDouble
- getPoints() : OpenMD::Cuboctahedron, OpenMD::CurlingStoneDecahedron, OpenMD::Decahedron, OpenMD::Icosahedron
- getPos() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getPotential() : OpenMD::Molecule
- getPressureTensor() : OpenMD::Thermo
- getPrevA() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getPrevCom() : OpenMD::Molecule
- getPrevDensity() : OpenMD::StuntDouble
- getPrevDipole() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getPrevElectricField() : OpenMD::StuntDouble
- getPrevEuler() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getPrevFlucQFrc() : OpenMD::StuntDouble
- getPrevFlucQPos() : OpenMD::StuntDouble
- getPrevFlucQVel() : OpenMD::StuntDouble
- getPrevFrc() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getPrevJ() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getPrevParticlePot() : OpenMD::StuntDouble
- getPrevPos() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getPrevQ() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getPrevQuadrupole() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getPrevSitePotential() : OpenMD::StuntDouble
- getPrevSnapshot() : OpenMD::SnapshotManager
- getPrevTrq() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getPrevValue() : OpenMD::Bend, OpenMD::Bond, OpenMD::Inversion, OpenMD::ShortRangeInteraction, OpenMD::Torsion
- getPrevVel() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getProperties() : OpenMD::AtomType, OpenMD::ConstraintElem, OpenMD::Molecule, OpenMD::NonBondedInteractionType, OpenMD::PropertyMap, OpenMD::ShortRangeInteraction, OpenMD::SimInfo, OpenMD::StuntDouble
- getPropertyByName() : OpenMD::AtomType, OpenMD::ConstraintElem, OpenMD::Molecule, OpenMD::NonBondedInteractionType, OpenMD::PropertyMap, OpenMD::ShortRangeInteraction, OpenMD::SimInfo, OpenMD::StuntDouble
- getPropertyNames() : OpenMD::AtomType, OpenMD::ConstraintElem, OpenMD::Molecule, OpenMD::NonBondedInteractionType, OpenMD::PropertyMap, OpenMD::ShortRangeInteraction, OpenMD::SimInfo, OpenMD::StuntDouble
- getQ() : JAMA::QR< Real >, OpenMD::ConstraintElem, OpenMD::StuntDouble
- getQuadrupole() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getR() : JAMA::QR< Real >
- getRangeValueAt() : OpenMD::ShapeAtomType
- getRealEigenvalues() : JAMA::Eigenvalue< Real >
- GetRed() : OpenMD::Element
- getRemainingString() : OpenMD::StringTokenizer
- getRestraintType() : OpenMD::Restraint
- GetRGB() : OpenMD::ElementsTable
- getRow() : OpenMD::DynamicRectMatrix< Real >, OpenMD::RectMatrix< Real, Row, Col >
- getS() : JAMA::SVD< Real >
- getSelectedAtomTypes() : OpenMD::SelectionManager
- getSimulatedAtomTypes() : OpenMD::SimInfo
- getSingularValues() : JAMA::SVD< Real >
- getSitePotential() : OpenMD::StuntDouble
- getSize() : OpenMD::DataStorage, OpenMD::PairList
- getSizeOfPairList() : OpenMD::PairList
- getSnapshotManager() : OpenMD::SimInfo
- getStampId() : OpenMD::Molecule
- getStdDev() : OpenMD::Accumulator, OpenMD::MatrixAccumulator, OpenMD::PotVecAccumulator, OpenMD::VectorAccumulator
- getStorageLayout() : OpenMD::DataStorage
- getStrengthValueAt() : OpenMD::ShapeAtomType
- GetSymbol() : OpenMD::Element, OpenMD::ElementsTable
- getSystemDipole() : OpenMD::Thermo
- getSystemQuadrupole() : OpenMD::Thermo
- getTabSize() : antlr::CharScanner
- getText() : antlr::AST, antlr::ASTNULLType, antlr::BaseAST, antlr::CharScanner, antlr::CommonAST, antlr::CommonToken
- getTokenName() : antlr::Parser, antlr::TreeParser
- getTokenNames() : antlr::Parser, antlr::TreeParser
- getTotal() : OpenMD::Accumulator, OpenMD::MatrixAccumulator, OpenMD::PotVecAccumulator, OpenMD::VectorAccumulator
- getTrq() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- getType() : antlr::AST, antlr::ASTNULLType, antlr::BaseAST, antlr::CommonAST, OpenMD::Atom, OpenMD::ConstraintElem, OpenMD::Molecule, OpenMD::RigidBody, OpenMD::StuntDouble
- getUpdatedDirection() : QuantLib::LineSearchBasedMethod
- getV() : JAMA::Eigenvalue< Real >
- getValue() : OpenMD::Bend, OpenMD::Bond, OpenMD::Inversion, OpenMD::ShortRangeInteraction, OpenMD::Torsion
- getVariance() : OpenMD::Accumulator, OpenMD::MatrixAccumulator, OpenMD::PotVecAccumulator, OpenMD::VectorAccumulator
- GetVdwRad() : OpenMD::Element, OpenMD::ElementsTable
- getVel() : OpenMD::ConstraintElem, OpenMD::StuntDouble
- gradient() : OpenMD::BoxObjectiveFunction, OpenMD::FluctuatingChargeObjectiveFunction, OpenMD::PotentialEnergyObjectiveFunction, QuantLib::ObjectiveFunction, QuantLib::Problem
- gradientEvaluation() : QuantLib::Problem
- gradientNormValue() : QuantLib::Problem