Here is a list of all class members with links to the classes they belong to:
- a -
- A
: PLMD::molfile::md_box
, PLMD::molfile::molfile_timestep_t
- a
: PLMD::SwitchingFunction
- a1
: PLMD::crystallization::Fccubic
- aa_kind
: PLMD::isdb::CS2BackboneDB
- aa_t
: PLMD::isdb::CS2Backbone
- ablocks
: PLMD::multicolvar::MultiColvarBase
- ABMD()
: PLMD::bias::ABMD
- Abort()
: PLMD::Communicator
- abortIfExceptionsAreDisabled()
: PLMD::Exception
- ABS
: PLMD::lepton::Operation
- Abs()
: PLMD::lepton::Operation
- acc
: PLMD::bias::MetaD
- acc_restart_mean_
: PLMD::bias::MetaD
- acceleration
: PLMD::bias::MetaD
- accession
: PLMD::molfile::molfile_metadata_t
- accumulate()
: PLMD::analysis::Analysis
, PLMD::analysis::AverageVessel
, PLMD::gridtools::AverageOnGrid
, PLMD::gridtools::HistogramOnGrid
- accumulateForce()
: PLMD::gridtools::AverageOnGrid
, PLMD::gridtools::HistogramOnGrid
- accumulateSymmetryFunction()
: PLMD::multicolvar::MultiColvarBase
- ACOS
: PLMD::lepton::Operation
- Acos()
: PLMD::lepton::Operation
- Action()
: PLMD::Action
, PLMD::ActionOptions
- action
: PLMD::analysis::LandmarkSelectionBase
, PLMD::analysis::LandmarkSelectionOptions
, PLMD::FileBase
, PLMD::function::FilesHandler
- Action
: PLMD::Keywords
- action
: PLMD::Value
, PLMD::vesselbase::Vessel
, PLMD::vesselbase::VesselOptions
- action_pntr_
: PLMD::ves::BasisFunctions
, PLMD::ves::CoeffsBase
, PLMD::ves::LinearBasisSetExpansion
, PLMD::ves::TargetDistribution
- ActionAtomistic()
: PLMD::ActionAtomistic
, PLMD::Atoms
- actionIsBridged
: PLMD::vesselbase::ActionWithVessel
- ActionOptions()
: PLMD::ActionOptions
- ActionPilot()
: PLMD::ActionPilot
- ActionRegister
: PLMD::ActionOptions
- actionRegister()
: PLMD::ActionRegister
- actions
: PLMD::Atoms
- ActionSet()
: PLMD::ActionSet
- actionSet
: PLMD::PlumedMain
- ActionSetup()
: PLMD::ActionSetup
- ActionVolume()
: PLMD::multicolvar::ActionVolume
- ActionWithArguments()
: PLMD::ActionWithArguments
- ActionWithAveraging()
: PLMD::vesselbase::ActionWithAveraging
- ActionWithGrid()
: PLMD::gridtools::ActionWithGrid
- ActionWithInputGrid()
: PLMD::gridtools::ActionWithInputGrid
, PLMD::gridtools::GridVessel
- ActionWithInputMatrix()
: PLMD::adjmat::ActionWithInputMatrix
, PLMD::adjmat::AdjacencyMatrixBase
, PLMD::adjmat::AdjacencyMatrixVessel
- ActionWithInputVessel()
: PLMD::vesselbase::ActionWithInputVessel
, PLMD::vesselbase::ActionWithVessel
- ActionWithIntegral()
: PLMD::gridtools::ActionWithIntegral
- ActionWithValue()
: PLMD::ActionWithValue
, PLMD::Value
- ActionWithVessel()
: PLMD::vesselbase::ActionWithVessel
, PLMD::vesselbase::Vessel
- ActionWithVirtualAtom()
: PLMD::ActionWithVirtualAtom
, PLMD::Atoms
- activate()
: PLMD::Action
, PLMD::DynamicList< T >
, PLMD::ves::CoeffsBase
- activateAll()
: PLMD::DynamicList< T >
- activated
: PLMD::gridtools::ConvertToFES
- activateIndices()
: PLMD::vesselbase::StoreDataVessel
- activateThesePoints()
: PLMD::gridtools::GridVessel
- active
: PLMD::Action
, PLMD::DynamicList< T >
, PLMD::gridtools::GridVessel
, PLMD::PlumedMain
, PLMD::ves::CoeffsBase
- active_der
: PLMD::vesselbase::StoreDataVessel
- active_elements
: PLMD::adjmat::Sprint
- actual_buffer_length
: PLMD::OFile
- ACYLINDRICITY
: PLMD::colvar::Gyration
- adaptive_
: PLMD::bias::MetaD
, PLMD::bias::PBMetaD
- AdaptiveHillsType
: PLMD::FlexibleBin
- AdaptivePath()
: PLMD::mapping::AdaptivePath
, PLMD::mapping::TrigonometricPathVessel
- add()
: PLMD::ActionRegister
, PLMD::analysis::LandmarkRegister
, PLMD::Atoms
, PLMD::CLToolRegister
, PLMD::Keywords
- ADD
: PLMD::lepton::Operation
- Add()
: PLMD::lepton::Operation
- add()
: PLMD::MetricRegister
, PLMD::Value
, PLMD::vesselbase::VesselRegister
- ADD_CONSTANT
: PLMD::lepton::Operation
- addActionThatUses()
: PLMD::vesselbase::StoreDataVessel
- addArgumentDerivatives()
: PLMD::ReferenceValuePack
- addAtomDerivatives()
: PLMD::multicolvar::MultiColvarBase
, PLMD::ReferenceValuePack
- addAtomsDerivatives()
: PLMD::multicolvar::AtomValuePack
- 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
- 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::Grid
- addKeywordToList()
: PLMD::ves::BasisFunctions
- addOneKernelAtATime
: PLMD::gridtools::HistogramOnGrid
- 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::multicolvar::AtomValuePack
, PLMD::MultiValue
, PLMD::SparseGrid
- addValueAndDerivatives()
: PLMD::Grid
, PLMD::SparseGrid
- addValueWithDerivatives()
: PLMD::ActionWithValue
, PLMD::function::Function
- addVessel()
: PLMD::vesselbase::ActionWithVessel
, PLMD::vesselbase::ShortcutVessel
- addVirtualAtom()
: PLMD::Atoms
- adj_list
: PLMD::adjmat::DFSClustering
, PLMD::adjmat::OutputCluster
- AdjacencyMatrixBase()
: PLMD::adjmat::AdjacencyMatrixBase
, PLMD::adjmat::AdjacencyMatrixVessel
- AdjacencyMatrixVessel
: PLMD::adjmat::AdjacencyMatrixBase
, PLMD::adjmat::AdjacencyMatrixVessel
- advanceField()
: PLMD::IFile
- after
: PLMD::Action
- ALA
: PLMD::isdb::CS2Backbone
- alEqDis
: PLMD::RMSDCoreData
- align
: PLMD::ReferenceAtoms
, PLMD::RMSD
, PLMD::RMSDCoreData
- align_atom_1
: PLMD::secondarystructure::SecondaryStructureRMSD
- align_atom_2
: PLMD::secondarystructure::SecondaryStructureRMSD
- align_strands
: PLMD::secondarystructure::SecondaryStructureRMSD
- aligned
: PLMD::generic::FitToTemplate
- AlignedMatrixBase()
: PLMD::adjmat::AlignedMatrixBase
- alignmentMethod
: PLMD::RMSD
- AlignmentMethod
: PLMD::RMSD
- alignType
: PLMD::secondarystructure::SecondaryStructureRMSD
- all
: PLMD::DynamicList< T >
- all_atoms
: PLMD::secondarystructure::SecondaryStructureRMSD
- allArguments
: PLMD::function::FuncPathMSD
- allcells
: PLMD::LinkCells
- allDeltaBias
: PLMD::GREX
- Allgather()
: PLMD::Communicator
- Allgatherv()
: PLMD::Communicator
- allow_bias_cutoff_
: PLMD::ves::TargetDistribution
- allowBiasCutoff()
: PLMD::ves::TargetDistribution
- allowedResidue()
: PLMD::MolDataClass
- allowIgnoredFields()
: PLMD::IFile
- allowmultiple
: PLMD::Keywords
- allowNoEOL()
: PLMD::IFile
- allowToAccessGlobalForces()
: PLMD::ActionAtomistic
- allthirdblockintasks
: PLMD::multicolvar::MultiColvarBase
- allWereActivated
: PLMD::DynamicList< T >
- allWereDeactivated
: PLMD::DynamicList< T >
- alpha
: PLMD::bias::MaxEnt
, PLMD::bias::MetaD::TemperingSpecs
, PLMD::crystallization::Fccubic
, PLMD::molfile::md_box
, PLMD::molfile::molfile_timestep_t
- AlphaBeta()
: PLMD::multicolvar::AlphaBeta
- AlphaRMSD()
: PLMD::secondarystructure::AlphaRMSD
- alphas_
: PLMD::ves::TD_GeneralizedNormal
- altloc
: PLMD::molfile::molfile_atom_t
- AltMin()
: PLMD::vesselbase::AltMin
- AM
: PLMD::Random
- Analysis()
: PLMD::analysis::Analysis
- analysis_
: PLMD::isdb::EMMI
- AnalysisWithLandmarks()
: PLMD::analysis::AnalysisWithLandmarks
, PLMD::analysis::LandmarkSelectionBase
- analyzeLandmarks()
: PLMD::analysis::AnalysisWithLandmarks
, PLMD::analysis::ClassicalMultiDimensionalScaling
- Angle()
: PLMD::colvar::Angle
- Angles()
: PLMD::multicolvar::Angles
- angleSwitch
: PLMD::adjmat::HBondMatrix
- angular_momentum
: PLMD::molfile::molfile_qm_basis_t
- AntibetaRMSD()
: PLMD::secondarystructure::AntibetaRMSD
- appendSuffix()
: PLMD::FileBase
- apply()
: PLMD::Action
, PLMD::ActionSetup
, PLMD::ActionWithVirtualAtom
, PLMD::adjmat::ClusteringBase
, PLMD::adjmat::DumpGraph
, PLMD::adjmat::OutputCluster
, PLMD::adjmat::Sprint
, PLMD::analysis::Analysis
, PLMD::analysis::Average
, PLMD::analysis::Committor
, PLMD::analysis::Histogram
, PLMD::bias::Bias
, PLMD::bias::ReweightBase
, PLMD::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::Print
, PLMD::generic::RandomExchanges
, PLMD::generic::Read
, PLMD::generic::ResetCell
, PLMD::generic::Time
, PLMD::generic::UpdateIf
, PLMD::generic::WholeMolecules
, PLMD::generic::WrapAround
, PLMD::gridtools::ActionWithInputGrid
, PLMD::gridtools::ActionWithIntegral
, PLMD::gridtools::GridPrintingBase
, 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::Pbc
, PLMD::secondarystructure::SecondaryStructureRMSD
, PLMD::ves::BasisFunctions
, PLMD::ves::Optimizer
, PLMD::ves::OutputBasisFunctions
, PLMD::ves::OutputFesBias
, PLMD::ves::OutputTargetDistribution
, PLMD::ves::TargetDistribution
, PLMD::ves::VesBias
- apply_bias()
: PLMD::eds::EDS
- apply_weights
: PLMD::bias::MaxEnt
- 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
- ARG
: PLMD::isdb::CS2Backbone
- arg_der_index
: PLMD::ReferenceArguments
- arg_eigv
: PLMD::analysis::PCA
- arg_names
: PLMD::gridtools::GridVessel
, PLMD::ReferenceArguments
- argc
: PLMD::CLToolMain
- argnames
: PLMD::Grid
- args
: PLMD::mapping::PathReparameterization
, PLMD::TargetDist
- args_
: PLMD::ves::CoeffsBase
- args_pntrs_
: PLMD::ves::LinearBasisSetExpansion
- argT_derivf_
: PLMD::ves::BasisFunctions
- argument_names
: PLMD::analysis::Analysis
- ArgumentOnlyDistance()
: PLMD::ArgumentOnlyDistance
- arguments
: PLMD::ActionWithArguments
, PLMD::lepton::CompiledExpression
, PLMD::vesselbase::ActionWithInputVessel
- argv
: PLMD::CLToolMain
- argValues
: PLMD::lepton::CompiledExpression
- Asin()
: PLMD::lepton::Operation
- ASIN
: PLMD::lepton::Operation
- ASN
: PLMD::isdb::CS2Backbone
- ASP
: PLMD::isdb::CS2Backbone
- ASPHERICITY
: PLMD::colvar::Gyration
- assign()
: PLMD::isdb::CS2BackboneDB
- async
: PLMD::Atoms::DomainDecomposition
- asyncSent
: PLMD::Atoms
- at
: PLMD::bias::LWalls
, PLMD::bias::MaxEnt
, PLMD::bias::MovingRestraint
, PLMD::bias::Restraint
, PLMD::bias::UWalls
, PLMD::manyrestraints::LWalls
, PLMD::manyrestraints::UWalls
- Atan()
: PLMD::lepton::Operation
- ATAN
: PLMD::lepton::Operation
- atLeastOneSet
: PLMD::MultiValue
- atm_kind
: PLMD::isdb::CS2BackboneDB
- atom
: PLMD::isdb::CS2Backbone
, PLMD::isdb::CS2Backbone::RingInfo
- atom_der_
: PLMD::isdb::EMMI
- atom_der_b_
: PLMD::isdb::EMMI
- atom_der_index
: PLMD::ReferenceAtoms
- atom_eigv
: PLMD::analysis::PCA
- atom_indices
: PLMD::ReferenceValuePack
- atom_kind()
: PLMD::isdb::CS2BackboneDB
- atom_lab
: PLMD::multicolvar::MultiColvarBase
- atom_t
: PLMD::isdb::CS2Backbone
- atomic_number
: PLMD::molfile::molfile_qm_basis_t
- atomicnumber
: PLMD::molfile::molfile_atom_t
- atomname
: PLMD::molfile::md_atom
- atomnum
: PLMD::molfile::md_atom
- AtomNumber()
: PLMD::AtomNumber
- atoms
: PLMD::ActionAtomistic
- Atoms()
: PLMD::Atoms
- atoms
: PLMD::generic::EffectiveEnergyDrift
, PLMD::generic::WrapAround
, PLMD::GREX
, PLMD::Keywords::KeyType
, PLMD::PlumedMain
- atomsin
: PLMD::adjmat::OutputCluster
- atomsNeeded
: PLMD::Atoms
- atomsWereRetrieved
: PLMD::multicolvar::MultiColvarBase
- atomsymb
: PLMD::PDB
- atomtags
: PLMD::Keywords
- AtomValuePack()
: PLMD::multicolvar::AtomValuePack
, PLMD::multicolvar::MultiColvarBase
- aux_coeffs_pntrs_
: PLMD::ves::Optimizer
- AuxCoeffs()
: PLMD::ves::Optimizer
- aver_counters
: PLMD::ves::VesBias
- aver_gradient_pntrs_
: PLMD::ves::Optimizer
- Average()
: PLMD::analysis::Average
- average
: PLMD::FlexibleBin
- average_weights_
: PLMD::isdb::Metainference
, PLMD::isdb::MetainferenceBase
- average_weights_stride_
: PLMD::isdb::Metainference
- averageMatrices()
: PLMD::ves::CoeffsMatrix
- AverageOnGrid()
: PLMD::gridtools::AverageOnGrid
- averageVectors()
: PLMD::ves::CoeffsVector
- AverageVessel()
: PLMD::analysis::AverageVessel
- averaging_counter
: PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- averaging_exp_decay_
: PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- AveragingVessel
: PLMD::vesselbase::ActionWithAveraging
, PLMD::vesselbase::AveragingVessel
- aves
: PLMD::manyrestraints::ManyRestraintsBase
- avg_bytes_per_timestep
: PLMD::molfile::molfile_qm_timestep_metadata
, PLMD::molfile::molfile_timestep_metadata
- avg_counter
: PLMD::bias::MaxEnt
- avg_coupling_count_
: PLMD::eds::EDS
- avglambda
: PLMD::bias::MaxEnt
- avglambda_restart
: PLMD::bias::MaxEnt
- avgstep
: PLMD::bias::MaxEnt
- avgx
: PLMD::bias::MaxEnt
- ax
: PLMD::Brent1DRootSearch< FCLASS >
, PLMD::Minimise1DBrent< FCLASS >