Here is a list of all functions with links to the classes they belong to:
- a -
- ABMD() : PLMD::bias::ABMD
- Abort() : PLMD::Communicator
- Abs() : PLMD::lepton::Operation::Abs
- accumulate() : PLMD::analysis::AverageVessel, PLMD::gridtools::AverageOnGrid, PLMD::gridtools::HistogramOnGrid
- accumulateAverage() : PLMD::analysis::Average, PLMD::vesselbase::ActionWithAveraging
- accumulateForce() : PLMD::gridtools::AverageOnGrid, PLMD::gridtools::HistogramOnGrid
- accumulateSymmetryFunction() : PLMD::multicolvar::MultiColvarBase
- Acos() : PLMD::lepton::Operation::Acos
- Action() : PLMD::Action
- ActionAnyorder() : PLMD::ActionAnyorder
- ActionAtomistic() : PLMD::ActionAtomistic
- ActionOptions() : PLMD::ActionOptions
- ActionPilot() : PLMD::ActionPilot
- actionRegister() : PLMD::ActionRegister
- ActionSet() : PLMD::ActionSet
- ActionSetup() : PLMD::ActionSetup
- ActionShortcut() : PLMD::ActionShortcut
- ActionVolume() : PLMD::multicolvar::ActionVolume
- ActionWithArguments() : PLMD::ActionWithArguments
- ActionWithAveraging() : PLMD::vesselbase::ActionWithAveraging
- ActionWithGrid() : PLMD::gridtools::ActionWithGrid
- ActionWithInputGrid() : PLMD::gridtools::ActionWithInputGrid
- ActionWithInputMatrix() : PLMD::adjmat::ActionWithInputMatrix
- ActionWithInputVessel() : PLMD::vesselbase::ActionWithInputVessel
- ActionWithIntegral() : PLMD::gridtools::ActionWithIntegral
- ActionWithValue() : PLMD::ActionWithValue
- ActionWithVessel() : PLMD::vesselbase::ActionWithVessel
- ActionWithVirtualAtom() : PLMD::ActionWithVirtualAtom, PLMD::vatom::ActionWithVirtualAtom
- activate() : PLMD::Action, PLMD::DataFetchingObject, PLMD::DynamicList< T >, PLMD::ves::CoeffsBase
- activateAll() : PLMD::DynamicList< T >
- activateIndices() : PLMD::vesselbase::StoreDataVessel
- activateParseOnlyMode() : PLMD::PlumedMain
- activateThesePoints() : PLMD::gridtools::GridVessel
- adaptive_random_search() : PLMD::maze::Memetic
- AdaptivePath() : PLMD::mapping::AdaptivePath
- Add() : PLMD::lepton::Operation::Add
- add() : PLMD::ActionRegister, PLMD::Atoms, PLMD::CLToolRegister, PLMD::Keywords, PLMD::MetricRegister, PLMD::Value, PLMD::vesselbase::VesselRegister
- addActionThatUses() : PLMD::vesselbase::StoreDataVessel
- addArgumentDerivatives() : PLMD::ReferenceValuePack
- addAtomDerivatives() : PLMD::multicolvar::MultiColvarBase, PLMD::ReferenceValuePack
- addAtomsDerivatives() : PLMD::multicolvar::AtomValuePack
- addBlockEnd() : PLMD::PDB
- addBoxDerivatives() : PLMD::multicolvar::AtomValuePack, PLMD::ReferenceValuePack
- addBridgeForces() : PLMD::multicolvar::MultiColvarFilter, PLMD::multicolvar::VolumeGradientBase, PLMD::vesselbase::ActionWithInputVessel
- addBridgingVessel() : PLMD::vesselbase::ActionWithVessel
- addCenter() : PLMD::RMSD
- addCoeffsSet() : PLMD::ves::VesBias
- addCoeffsSetIDsToFilenames() : PLMD::ves::Optimizer
- addColvar() : PLMD::secondarystructure::SecondaryStructureRMSD
- addComDerivatives() : PLMD::multicolvar::AtomValuePack, PLMD::multicolvar::MultiColvarBase
- addComponent() : PLMD::ActionWithValue
- addComponentWithDerivatives() : PLMD::ActionWithValue, PLMD::function::Function
- addConnectionDerivatives() : PLMD::adjmat::ActionWithInputMatrix
- AddConstant() : PLMD::lepton::Operation::AddConstant
- addConstantField() : PLMD::OFile
- addDataElement() : PLMD::vesselbase::AveragingVessel
- addDependency() : PLMD::Action
- addDerivative() : PLMD::multicolvar::AtomValuePack, PLMD::MultiValue, PLMD::Value
- addDerivativesOnMatrixElement() : PLMD::adjmat::AdjacencyMatrixBase
- addDirection() : PLMD::Direction
- addFlag() : PLMD::Keywords
- addForce() : PLMD::Value
- addForcesOnArguments() : PLMD::ActionWithArguments, PLMD::vesselbase::ActionWithInputVessel
- addForcesOnAtoms() : PLMD::crystallization::VectorMultiColvar
- addGaussian() : PLMD::bias::MetaD, PLMD::bias::PBMetaD
- addGrid() : PLMD::BiasRepresentation
- addIndexToList() : PLMD::DynamicList< T >
- addKernel() : PLMD::GridBase, PLMD::opes::OPESmetad< mode >
- addKeywordToList() : PLMD::ves::BasisFunctions
- addOneKernelEachTimeOnly() : PLMD::gridtools::HistogramOnGrid
- addOutputComponent() : PLMD::Keywords
- addRemark() : PLMD::PDB
- addRequiredCells() : PLMD::LinkCells
- addTaskToList() : PLMD::multicolvar::MultiColvarBase, PLMD::vesselbase::ActionWithVessel
- addTemporyAtomsDerivatives() : PLMD::multicolvar::AtomValuePack
- addTemporyBoxDerivatives() : PLMD::multicolvar::AtomValuePack
- addTemporyDerivative() : PLMD::MultiValue
- addTemporyValue() : PLMD::MultiValue
- addToAverage() : PLMD::ves::CoeffsMatrix, PLMD::ves::CoeffsVector
- addToGridElement() : PLMD::gridtools::GridVessel
- addToSampledAverages() : PLMD::ves::VesBias
- addToValue() : PLMD::ves::CoeffsMatrix, PLMD::ves::CoeffsVector
- addToValues() : PLMD::ves::CoeffsMatrix, PLMD::ves::CoeffsVector
- addValue() : PLMD::ActionWithValue, PLMD::Grid, PLMD::GridBase, PLMD::multicolvar::AtomValuePack, PLMD::MultiValue, PLMD::SparseGrid
- addValueAndDerivatives() : PLMD::Grid, PLMD::GridBase, PLMD::SparseGrid
- addValueWithDerivatives() : PLMD::ActionWithValue, PLMD::function::Function
- addVessel() : PLMD::vesselbase::ActionWithVessel, PLMD::vesselbase::ShortcutVessel
- addVirtualAtom() : PLMD::Atoms
- AdjacencyMatrixBase() : PLMD::adjmat::AdjacencyMatrixBase
- AdjacencyMatrixVessel() : PLMD::adjmat::AdjacencyMatrixVessel
- advanceField() : PLMD::IFile
- AlignedMatrixBase() : PLMD::adjmat::AlignedMatrixBase
- Allgather() : PLMD::Communicator
- Allgatherv() : PLMD::Communicator
- allowBiasCutoff() : PLMD::ves::TargetDistribution
- allowedResidue() : PLMD::MolDataClass, PLMD::PDB
- allowIgnoredFields() : PLMD::IFile
- allowNoEOL() : PLMD::IFile
- allowToAccessGlobalForces() : PLMD::ActionAtomistic
- AlphaBeta() : PLMD::multicolvar::AlphaBeta
- AlphaRMSD() : PLMD::secondarystructure::AlphaRMSD
- AltMin() : PLMD::vesselbase::AltMin
- AnalysisBase() : PLMD::analysis::AnalysisBase
- Angle() : PLMD::colvar::Angle
- Angles() : PLMD::multicolvar::Angles
- ANN() : PLMD::function::annfunc::ANN
- annealing() : PLMD::maze::Memetic
- AntibetaRMSD() : PLMD::secondarystructure::AntibetaRMSD
- appendSuffix() : PLMD::FileBase
- apply() : PLMD::Action, PLMD::ActionAnyorder, PLMD::ActionSetup, PLMD::ActionShortcut, PLMD::ActionWithVirtualAtom, PLMD::adjmat::ClusteringBase, PLMD::adjmat::DumpGraph, PLMD::adjmat::OutputCluster, PLMD::adjmat::Sprint, PLMD::analysis::AnalysisBase, PLMD::analysis::Average, PLMD::analysis::Committor, PLMD::analysis::Histogram, PLMD::bias::Bias, PLMD::bias::ReweightBase, PLMD::Colvar, PLMD::colvar::Colvar, PLMD::function::Function, PLMD::generic::Debug, PLMD::generic::DumpAtoms, PLMD::generic::DumpDerivatives, PLMD::generic::DumpForces, PLMD::generic::DumpMassCharge, PLMD::generic::DumpProjections, PLMD::generic::EffectiveEnergyDrift, PLMD::generic::EndPlumed, PLMD::generic::FitToTemplate, PLMD::generic::Flush, PLMD::generic::Group, PLMD::generic::Include, PLMD::generic::Plumed, PLMD::generic::Print, PLMD::generic::RandomExchanges, PLMD::generic::Read, PLMD::generic::ResetCell, PLMD::generic::Time, PLMD::generic::UpdateIf, PLMD::generic::WholeMolecules, PLMD::generic::WrapAround, PLMD::GenericMolInfo, PLMD::gridtools::ActionWithInputGrid, PLMD::gridtools::ActionWithIntegral, PLMD::gridtools::GridPrintingBase, PLMD::isdb::EMMI, PLMD::isdb::MetainferenceBase, PLMD::isdb::Selector, PLMD::manyrestraints::ManyRestraintsBase, PLMD::mapping::Mapping, PLMD::mapping::PCAVars, PLMD::multicolvar::BridgedMultiColvarFunction, PLMD::multicolvar::DistanceFromContour, PLMD::multicolvar::DumpMultiColvar, PLMD::multicolvar::MultiColvarBase, PLMD::multicolvar::MultiColvarDensity, PLMD::opes::ExpansionCVs, PLMD::Pbc, PLMD::sasa::Colvar, PLMD::secondarystructure::SecondaryStructureRMSD, PLMD::vatom::ActionWithVirtualAtom, PLMD::ves::BasisFunctions, PLMD::ves::Optimizer, PLMD::ves::OutputBasisFunctions, PLMD::ves::OutputFesBias, PLMD::ves::OutputTargetDistribution, PLMD::ves::TargetDistribution
- apply_bias() : PLMD::eds::EDS, PLMD::fisst::FISST
- applyBiasCutoff() : PLMD::ves::VesBias
- applyBridgeForces() : PLMD::manyrestraints::ManyRestraintsBase, PLMD::multicolvar::BridgedMultiColvarFunction, PLMD::vesselbase::ActionWithInputVessel, PLMD::vesselbase::ActionWithVessel
- applyFilter() : PLMD::multicolvar::FilterBetween, PLMD::multicolvar::FilterLess, PLMD::multicolvar::FilterMore, PLMD::multicolvar::MultiColvarFilter
- applyForce() : PLMD::gridtools::GridVessel, PLMD::mapping::TrigonometricPathVessel, PLMD::Value, PLMD::vesselbase::AveragingVessel, PLMD::vesselbase::BridgeVessel, PLMD::vesselbase::Moments, PLMD::vesselbase::ShortcutVessel, PLMD::vesselbase::StoreDataVessel, PLMD::vesselbase::ValueVessel, PLMD::vesselbase::Vessel
- applyForces() : PLMD::ActionAtomistic
- applyFunctionAllValuesAndDerivatives() : PLMD::Grid
- applyPbc() : PLMD::multicolvar::MultiColvarBase
- applyPeriodicity() : PLMD::Value
- applyTargetDistModiferToGrid() : PLMD::ves::TargetDistribution
- areConnected() : PLMD::adjmat::ClusterAnalysisBase, PLMD::adjmat::ClusteringBase
- arePeriodic() : PLMD::ves::BasisFunctions
- ArgumentOnlyDistance() : PLMD::ArgumentOnlyDistance
- Asin() : PLMD::lepton::Operation::Asin
- AsmJitRuntimePtr() : PLMD::lepton::AsmJitRuntimePtr
- Assertion() : PLMD::Exception::Assertion
- assign() : PLMD::isdb::CS2BackboneDB
- assignTags() : PLMD::lepton::ExpressionTreeNode
- Atan() : PLMD::lepton::Operation::Atan
- Atan2() : PLMD::lepton::Operation::Atan2
- atom_kind() : PLMD::isdb::CS2BackboneDB
- AtomNumber() : PLMD::AtomNumber
- Atoms() : PLMD::Atoms
- AtomValuePack() : PLMD::multicolvar::AtomValuePack
- AuxCoeffs() : PLMD::ves::Optimizer
- auxiliaryConstructor() : PLMD::TensorGeneric< n, m >, PLMD::VectorGeneric< n >
- available() : PLMD::Subprocess
- Average() : PLMD::analysis::Average
- averageMatrices() : PLMD::ves::CoeffsMatrix
- AverageOnGrid() : PLMD::gridtools::AverageOnGrid
- averageVectors() : PLMD::ves::CoeffsVector
- AverageVessel() : PLMD::analysis::AverageVessel
- AveragingVessel() : PLMD::vesselbase::AveragingVessel