Here is a list of all class members with links to the classes they belong to:
- r -
- r
: PLMD::Communicator::Request
- r00
: PLMD::piv::PIV
- R0_
: PLMD::isdb::FretEfficiency
- r0_
: PLMD::ves::FermiSwitchingFunction
- r_eff_
: PLMD::s2cm::S2ContactModel
- r_globalshift_
: PLMD::s2cm::S2ContactModel
- R_HIS
: PLMD::isdb::CS2Backbone::RingInfo
- r_min_
: PLMD::maze::Random_Acceleration_MD
- R_PHE
: PLMD::isdb::CS2Backbone::RingInfo
- r_power
: PLMD::multicolvar::CoordinationNumbers
- R_TRP1
: PLMD::isdb::CS2Backbone::RingInfo
- R_TRP2
: PLMD::isdb::CS2Backbone::RingInfo
- R_TYR
: PLMD::isdb::CS2Backbone::RingInfo
- RADIUS
: PLMD::colvar::Gyration
- radius
: PLMD::molfile::molfile_atom_t
- rand
: PLMD::bias::ExtendedLagrangian
- rand_
: PLMD::eds::EDS
, PLMD::fisst::FISST
- RandInt()
: PLMD::Random
- random
: PLMD::bias::ABMD
, PLMD::ExchangePatterns
- RANDOM
: PLMD::ExchangePatterns
- random
: PLMD::isdb::Metainference
, PLMD::isdb::MetainferenceBase
- Random()
: PLMD::Random
- random_
: PLMD::isdb::EMMI
- Random_Acceleration_MD()
: PLMD::maze::Random_Acceleration_MD
- random_fwd
: PLMD::ExchangePatterns
- random_restart_hill_climbing()
: PLMD::maze::Memetic
- Random_Walk()
: PLMD::maze::Random_Walk
- RandomExchanges()
: PLMD::generic::RandomExchanges
- randomize()
: PLMD::maze::rnd
- randomize_velocities()
: PLMD::cltools::SimpleMD
- randomizeValuesGaussian()
: PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- RandU01()
: PLMD::Random
- rank
: PLMD::DynamicList< T >
- rank_
: PLMD::isdb::EMMI
, PLMD::maze::Optimizer
, PLMD::opes::OPESexpanded
, PLMD::opes::OPESmetad< mode >
, PLMD::ves::VesDeltaF
- rational
: PLMD::SwitchingFunction
- rct_
: PLMD::opes::OPESexpanded
- rct_ustride_
: PLMD::bias::MetaD
- rcut
: PLMD::crystallization::Steinhardt
- rcut2
: PLMD::adjmat::OutputCluster
, PLMD::crystallization::BondOrientation
, PLMD::crystallization::CubicHarmonicBase
, PLMD::crystallization::OrientationSphere
, PLMD::crystallization::Steinhardt
, PLMD::multicolvar::CoordinationNumbers
, PLMD::multicolvar::DistanceFromContour
, PLMD::multicolvar::LocalAverage
, PLMD::pamm::HBPammHydrogens
- rcut2_
: PLMD::crystallization::EnvironmentSimilarity
- rcut2_1
: PLMD::multicolvar::Angles
- rcut2_2
: PLMD::multicolvar::Angles
- rcut_surf2
: PLMD::adjmat::ClusterWithSurface
- RCYL
: PLMD::funnel::Funnel
- RDC()
: PLMD::isdb::RDC
- read()
: PLMD::ArgumentOnlyDistance
, PLMD::Direction
, PLMD::DotProductDistance
, PLMD::DRMSD
, PLMD::FakeFrame
- Read()
: PLMD::generic::Read
- read
: PLMD::IFile::Field
, PLMD::IntermolecularDRMSD
, PLMD::IntramolecularDRMSD
, PLMD::KernelFunctions
, PLMD::MultiDomainRMSD
, PLMD::OptimalRMSD
, PLMD::PDB
, PLMD::ReferenceConfiguration
, PLMD::SimpleRMSD
, PLMD::TargetDist
- read_angles
: PLMD::molfile::molfile_plugin_t
- read_backbone
: PLMD::GenericMolInfo
- read_bias()
: PLMD::isdb::Rescale
- read_bonds
: PLMD::molfile::molfile_plugin_t
- read_exp_errors()
: PLMD::isdb::EMMI
- read_exp_overlaps()
: PLMD::isdb::EMMI
- read_input()
: PLMD::cltools::PesMD
, PLMD::cltools::SimpleMD
- read_inputfiles()
: PLMD::drr::UIestimator::UIestimator
- read_molecule_metadata
: PLMD::molfile::molfile_plugin_t
- read_natoms()
: PLMD::cltools::SimpleMD
- read_next_timestep
: PLMD::molfile::molfile_plugin_t
- read_positions()
: PLMD::cltools::SimpleMD
- read_qm_metadata
: PLMD::molfile::molfile_plugin_t
- read_qm_rundata
: PLMD::molfile::molfile_plugin_t
- read_qm_timestep_metadata
: PLMD::molfile::molfile_plugin_t
- read_rawgraphics
: PLMD::molfile::molfile_plugin_t
- read_status()
: PLMD::isdb::EMMI
- read_structure
: PLMD::molfile::molfile_plugin_t
- read_timestep
: PLMD::molfile::molfile_plugin_t
- read_timestep_metadata
: PLMD::molfile::molfile_plugin_t
- read_volumetric_data
: PLMD::molfile::molfile_plugin_t
- read_volumetric_data_ex
: PLMD::molfile::molfile_plugin_t
- read_volumetric_metadata
: PLMD::molfile::molfile_plugin_t
- ReadAnalysisFrames
: PLMD::analysis::DataCollectionObject
, PLMD::analysis::ReadAnalysisFrames
- readArgument()
: PLMD::vesselbase::ActionWithInputVessel
- readArgumentsFromPDB()
: PLMD::ReferenceArguments
- readAtomsFromPDB()
: PLMD::Action
, PLMD::ActionAtomistic
, PLMD::ReferenceAtoms
- readAtomsLikeKeyword()
: PLMD::multicolvar::MultiColvarBase
- readBackboneAtoms()
: PLMD::secondarystructure::SecondaryStructureRMSD
- readBinary()
: PLMD::Atoms
- readBounds()
: PLMD::DRMSD
- readBunch()
: PLMD::function::FilesHandler
- readCoeffsFromFiles()
: PLMD::ves::Optimizer
, PLMD::ves::VesBias
- readCommandLineArgs()
: PLMD::CLTool
- readDataFromFile()
: PLMD::ves::CoeffsVector
- readDeltaG()
: PLMD::sasa::SASA_HASEL
, PLMD::sasa::SASA_LCPO
- ReadDissimilarityMatrix
: PLMD::analysis::AnalysisBase
, PLMD::analysis::ReadDissimilarityMatrix
- readFromFile()
: PLMD::ves::CoeffsVector
- readFromFilepointer()
: PLMD::PDB
- readFromPoint()
: PLMD::BiasRepresentation
- readGaussians()
: PLMD::bias::MetaD
, PLMD::bias::PBMetaD
- readGroupKeywords()
: PLMD::multicolvar::MultiColvarBase
- readHeaderFromFile()
: PLMD::ves::CoeffsVector
- readInput()
: PLMD::CLTool
- readInputFile()
: PLMD::CLTool
, PLMD::PlumedMain
- readInputLine()
: PLMD::ActionShortcut
, PLMD::PlumedMain
- readInputLines()
: PLMD::PlumedMain
- readInputWords()
: PLMD::PlumedMain
- readInRestart()
: PLMD::eds::EDS
, PLMD::fisst::FISST
- readInRestartTargetDistGrid()
: PLMD::ves::TargetDistribution
- readInRestartTargetDistribution()
: PLMD::ves::LinearBasisSetExpansion
- ReadLagrangians()
: PLMD::bias::MaxEnt
- readLCPOparam()
: PLMD::sasa::SASA_LCPO
- readMaxSurf()
: PLMD::sasa::SASA_HASEL
, PLMD::sasa::SASA_LCPO
- readMaxThreeSpeciesMatrix()
: PLMD::adjmat::AdjacencyMatrixBase
- readMaxTwoSpeciesMatrix()
: PLMD::adjmat::AdjacencyMatrixBase
- readOneSetFromFile()
: PLMD::ves::CoeffsVector
- readOrientationConnector()
: PLMD::adjmat::AlignedMatrixBase
, PLMD::adjmat::ContactAlignedMatrix
, PLMD::adjmat::SMACMatrix
- readPDB()
: PLMD::sasa::SASA_HASEL
, PLMD::sasa::SASA_LCPO
- readReference()
: PLMD::SingleDomainRMSD
- readSASAparam()
: PLMD::sasa::SASA_HASEL
- ReadStateFull()
: PLMD::Random
- readTemperingSpecs()
: PLMD::bias::MetaD
- readThreeGroups()
: PLMD::multicolvar::MultiColvarBase
- readTwoGroups()
: PLMD::multicolvar::MultiColvarBase
- readvals
: PLMD::generic::Read
- readVesselKeywords()
: PLMD::vesselbase::ActionWithVessel
- real_output
: PLMD::gridtools::FourierTransform
- realToScaled()
: PLMD::Pbc
- recalculateMatrixElement()
: PLMD::adjmat::AdjacencyMatrixBase
- recalculateStoredQuantity()
: PLMD::vesselbase::StoreDataVessel
- recalculateWeights()
: PLMD::dimred::SketchMapSmacof
- Reciprocal()
: PLMD::lepton::Operation
- RECIPROCAL
: PLMD::lepton::Operation
- recursive_merge_
: PLMD::opes::OPESmetad< mode >
- Recv()
: PLMD::Communicator
- reduce()
: PLMD::LatticeReduction
- reduce2()
: PLMD::LatticeReduction
- reduced
: PLMD::NeighborList
, PLMD::Pbc
- reduceFast()
: PLMD::LatticeReduction
- reduceSlow()
: PLMD::LatticeReduction
- ref
: PLMD::SwitchingFunction
- ref_file
: PLMD::piv::PIV
- reference
: PLMD::colvar::ContactMap
, PLMD::colvar::PathMSDBase
, PLMD::function::FuncPathGeneral
, PLMD::generic::WrapAround
, PLMD::GenericMolInfo
, PLMD::RMSD
, PLMD::RMSDCoreData
- reference_args
: PLMD::ReferenceArguments
- reference_atoms
: PLMD::ReferenceAtoms
- reference_center
: PLMD::RMSD
- reference_center_is_calculated
: PLMD::RMSD
- reference_center_is_removed
: PLMD::RMSD
- reference_mat
: PLMD::ERMSD
- ReferenceArguments()
: PLMD::ReferenceArguments
- ReferenceAtoms()
: PLMD::ReferenceAtoms
- ReferenceConfiguration
: PLMD::ReferenceArguments
, PLMD::ReferenceAtoms
, PLMD::ReferenceConfiguration
, PLMD::ReferenceConfigurationOptions
- ReferenceConfigurationOptions()
: PLMD::ReferenceConfigurationOptions
- references
: PLMD::secondarystructure::SecondaryStructureRMSD
- ReferenceValuePack()
: PLMD::ReferenceValuePack
- refs
: PLMD::generic::WholeMolecules
- registerKeywords()
: PLMD::Action
, PLMD::ActionAnyorder
, PLMD::ActionAtomistic
, PLMD::ActionPilot
, PLMD::ActionSetup
, PLMD::ActionShortcut
, PLMD::ActionWithArguments
, PLMD::ActionWithValue
, PLMD::ActionWithVirtualAtom
, PLMD::adjmat::ActionWithInputMatrix
, PLMD::adjmat::AdjacencyMatrixBase
, PLMD::adjmat::AdjacencyMatrixVessel
, PLMD::adjmat::AlignedMatrixBase
, PLMD::adjmat::ClusterAnalysisBase
, PLMD::adjmat::ClusterDiameter
, PLMD::adjmat::ClusterDistribution
, PLMD::adjmat::ClusteringBase
, PLMD::adjmat::ClusterProperties
, PLMD::adjmat::ClusterSize
, PLMD::adjmat::ClusterWithSurface
, PLMD::adjmat::ContactAlignedMatrix
, PLMD::adjmat::ContactMatrix
, PLMD::adjmat::DFSClustering
, PLMD::adjmat::DumpGraph
, PLMD::adjmat::HBondMatrix
, PLMD::adjmat::MatrixColumnSums
, PLMD::adjmat::MatrixRowSums
, PLMD::adjmat::OutputCluster
, PLMD::adjmat::SMACMatrix
, PLMD::adjmat::Sprint
, PLMD::adjmat::TopologyMatrix
, PLMD::analysis::AnalysisBase
, PLMD::analysis::Average
, PLMD::analysis::AverageVessel
, PLMD::analysis::Committor
, PLMD::analysis::EuclideanDissimilarityMatrix
, PLMD::analysis::FarthestPointSampling
, PLMD::analysis::Histogram
, PLMD::analysis::LandmarkSelectionBase
, PLMD::analysis::LandmarkStaged
, PLMD::analysis::OutputColvarFile
, PLMD::analysis::OutputPDBFile
, PLMD::analysis::PrintDissimilarityMatrix
, PLMD::analysis::ReadAnalysisFrames
, PLMD::analysis::ReadDissimilarityMatrix
, PLMD::analysis::ReselectLandmarks
, PLMD::analysis::SelectRandomFrames
, PLMD::analysis::SelectWithStride
, PLMD::analysis::WhamHistogram
, PLMD::analysis::WhamWeights
, PLMD::bias::ABMD
, PLMD::bias::Bias
, PLMD::bias::BiasValue
, PLMD::bias::ExtendedLagrangian
, PLMD::bias::External
, PLMD::bias::LWalls
, PLMD::bias::MaxEnt
, PLMD::bias::MetaD
, PLMD::bias::MovingRestraint
, PLMD::bias::PBMetaD
, PLMD::bias::Restraint
, PLMD::bias::ReweightBase
, PLMD::bias::ReweightBias
, PLMD::bias::ReweightMetad
, PLMD::bias::ReweightTemperaturePressure
, PLMD::bias::ReweightWham
, PLMD::bias::UWalls
, PLMD::CLTool
, PLMD::cltools::CLToolSumHills
, PLMD::cltools::Completion
, PLMD::cltools::Driver< real >
, PLMD::cltools::GenExample
, PLMD::cltools::GenTemplate
, PLMD::cltools::Info
, PLMD::cltools::kt
, PLMD::cltools::Manual
, PLMD::cltools::PdbRenumber
, PLMD::cltools::PesMD
, PLMD::cltools::SimpleMD
, PLMD::colvar::Angle
, PLMD::colvar::Cell
, PLMD::colvar::ColvarFake
, PLMD::colvar::Constant
, PLMD::colvar::ContactMap
, PLMD::colvar::Coordination
, PLMD::colvar::CoordinationBase
, PLMD::colvar::DHEnergy
, PLMD::colvar::Dimer
, PLMD::colvar::Dipole
, PLMD::colvar::Distance
, PLMD::colvar::DRMSD
, PLMD::colvar::EEFSolv
, PLMD::colvar::Energy
, PLMD::colvar::ERMSD
, PLMD::colvar::ExtraCV
, PLMD::colvar::GHBFIX
, PLMD::colvar::Gyration
, PLMD::colvar::MultiRMSD
, PLMD::colvar::PathMSD
, PLMD::colvar::PathMSDBase
, PLMD::colvar::PCARMSD
, PLMD::colvar::Position
, PLMD::colvar::ProjectionOnAxis
, PLMD::colvar::PropertyMap
, PLMD::colvar::Puckering
, PLMD::Colvar
, PLMD::colvar::RMSD
, PLMD::colvar::Template
, PLMD::colvar::Torsion
, PLMD::colvar::Volume
, PLMD::crystallization::BondOrientation
, PLMD::crystallization::CubicHarmonicBase
, PLMD::crystallization::EnvironmentSimilarity
, PLMD::crystallization::Fccubic
, PLMD::crystallization::Gradient
, PLMD::crystallization::GradientVessel
, PLMD::crystallization::InterMolecularTorsions
, PLMD::crystallization::LocalSteinhardt< T >
, PLMD::crystallization::MoleculeOrientation
, PLMD::crystallization::MoleculePlane
, PLMD::crystallization::OrientationSphere
, PLMD::crystallization::PolymerAngles
, PLMD::crystallization::Q3
, PLMD::crystallization::Q4
, PLMD::crystallization::Q6
, PLMD::crystallization::SimpleCubic
, PLMD::crystallization::SMAC
, PLMD::crystallization::Steinhardt
, PLMD::crystallization::Tetrahedral
, PLMD::crystallization::VectorMean
, PLMD::crystallization::VectorMultiColvar
, PLMD::crystallization::VectorSum
, PLMD::dimred::ClassicalMultiDimensionalScaling
, PLMD::dimred::DimensionalityReductionBase
, PLMD::dimred::OutputPCAProjection
, PLMD::dimred::PCA
, PLMD::dimred::ProjectNonLandmarkPoints
, PLMD::dimred::SketchMap
, PLMD::dimred::SketchMapBase
, PLMD::dimred::SketchMapConjGrad
, PLMD::dimred::SketchMapPointwise
, PLMD::dimred::SketchMapRead
, PLMD::dimred::SketchMapSmacof
, PLMD::dimred::SmacofMDS
, PLMD::eds::EDS
, PLMD::fisst::FISST
, PLMD::function::annfunc::ANN
, PLMD::function::Combine
, PLMD::function::Custom
, PLMD::function::Ensemble
, PLMD::function::FuncPathGeneral
, PLMD::function::FuncPathMSD
, PLMD::function::FuncSumHills
, PLMD::function::Function
, PLMD::function::LocalEnsemble
, PLMD::function::Piecewise
, PLMD::function::Sort
, PLMD::function::Stats
, PLMD::function::Target
, PLMD::funnel::Funnel
, PLMD::funnel::FUNNEL_PS
, 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::ActionWithGrid
, PLMD::gridtools::ActionWithInputGrid
, PLMD::gridtools::ActionWithIntegral
, PLMD::gridtools::AverageOnGrid
, PLMD::gridtools::ContourFindingBase
, PLMD::gridtools::ConvertToFES
, PLMD::gridtools::DumpCube
, PLMD::gridtools::DumpGrid
, PLMD::gridtools::FindContour
, PLMD::gridtools::FindContourSurface
, PLMD::gridtools::FindSphericalContour
, PLMD::gridtools::FourierTransform
, PLMD::gridtools::GridPrintingBase
, PLMD::gridtools::GridToXYZ
, PLMD::gridtools::GridVessel
, PLMD::gridtools::HistogramOnGrid
, PLMD::gridtools::IntegrateGrid
, PLMD::gridtools::InterpolateGrid
, PLMD::HistogramBead
, PLMD::isdb::Caliber
, PLMD::isdb::CS2Backbone
, PLMD::isdb::EMMI
, PLMD::isdb::FretEfficiency
, PLMD::isdb::JCoupling
, PLMD::isdb::Metainference
, PLMD::isdb::MetainferenceBase
, PLMD::isdb::NOE
, PLMD::isdb::PRE
, PLMD::isdb::RDC
, PLMD::isdb::Rescale
, PLMD::isdb::SAXS
, PLMD::isdb::Select
, PLMD::isdb::Selector
, PLMD::logmfd::LogMFD
, PLMD::manyrestraints::LWalls
, PLMD::manyrestraints::ManyRestraintsBase
, PLMD::manyrestraints::UWalls
, PLMD::mapping::AdaptivePath
, PLMD::mapping::Mapping
, PLMD::mapping::Path
, PLMD::mapping::PathBase
, PLMD::mapping::PathTools
, PLMD::mapping::PCAVars
, PLMD::mapping::PropertyMap
, PLMD::mapping::SpathVessel
, PLMD::mapping::TrigonometricPathVessel
, PLMD::mapping::ZpathVessel
, PLMD::maze::Loss
, PLMD::maze::Memetic
, PLMD::maze::Optimizer
, PLMD::maze::OptimizerBias
, PLMD::maze::Random_Acceleration_MD
, PLMD::maze::Random_Walk
, PLMD::maze::Simulated_Annealing
, PLMD::maze::Steered_MD
, PLMD::multicolvar::ActionVolume
, PLMD::multicolvar::AlphaBeta
, PLMD::multicolvar::Angles
, PLMD::multicolvar::Bridge
, PLMD::multicolvar::BridgedMultiColvarFunction
, PLMD::multicolvar::CenterOfMultiColvar
, PLMD::multicolvar::CoordinationNumbers
, PLMD::multicolvar::Density
, PLMD::multicolvar::DihedralCorrelation
, PLMD::multicolvar::DistanceFromContour
, PLMD::multicolvar::Distances
, PLMD::multicolvar::DumpMultiColvar
, PLMD::multicolvar::FilterBetween
, PLMD::multicolvar::FilterLess
, PLMD::multicolvar::FilterMore
, PLMD::multicolvar::InPlaneDistances
, PLMD::multicolvar::LocalAverage
, PLMD::multicolvar::MultiColvarBase
, PLMD::multicolvar::MultiColvarCombine
, PLMD::multicolvar::MultiColvarDensity
, PLMD::multicolvar::MultiColvarFilter
, PLMD::multicolvar::MultiColvarProduct
, PLMD::multicolvar::NumberOfLinks
, PLMD::multicolvar::Torsions
, PLMD::multicolvar::VolumeAround
, PLMD::multicolvar::VolumeCavity
, PLMD::multicolvar::VolumeGradientBase
, PLMD::multicolvar::VolumeInCylinder
, PLMD::multicolvar::VolumeInEnvelope
, PLMD::multicolvar::VolumeInSphere
, PLMD::multicolvar::VolumeTetrapore
, PLMD::multicolvar::XAngles
, PLMD::multicolvar::XDistances
, PLMD::multicolvar::XYDistances
, PLMD::multicolvar::XYTorsion
, PLMD::opes::ECVcustom
, PLMD::opes::ECVlinear
, PLMD::opes::ECVmultiThermal
, PLMD::opes::ECVmultiThermalBaric
, PLMD::opes::ECVumbrellasFile
, PLMD::opes::ECVumbrellasLine
, PLMD::opes::ExpansionCVs
, PLMD::opes::OPESexpanded
, PLMD::opes::OPESmetad< mode >
, PLMD::pamm::HBPammHydrogens
, PLMD::pamm::HBPammMatrix
, PLMD::pamm::PAMM
, PLMD::piv::PIV
, PLMD::s2cm::S2ContactModel
, PLMD::sasa::SASA_HASEL
, PLMD::sasa::SASA_LCPO
, PLMD::secondarystructure::AlphaRMSD
, PLMD::secondarystructure::AntibetaRMSD
, PLMD::secondarystructure::ParabetaRMSD
, PLMD::secondarystructure::SecondaryStructureRMSD
, PLMD::setup::Load
, PLMD::setup::Restart
, PLMD::setup::Units
, PLMD::SwitchingFunction
, PLMD::vatom::Center
, PLMD::vatom::FixedAtom
, PLMD::vatom::Ghost
, PLMD::ves::BasisFunctions
, PLMD::ves::BF_Chebyshev
, PLMD::ves::BF_Combined
, PLMD::ves::BF_Cosine
, PLMD::ves::BF_CubicBsplines
, PLMD::ves::BF_Custom
, PLMD::ves::BF_Fourier
, PLMD::ves::BF_Gaussians
, PLMD::ves::BF_Legendre
, PLMD::ves::BF_Powers
, PLMD::ves::BF_Sine
, PLMD::ves::BF_Wavelets
, PLMD::ves::FermiSwitchingFunction
, PLMD::ves::LinearBasisSetExpansion
, PLMD::ves::MD_LinearExpansionPES
, PLMD::ves::Opt_Adam
, PLMD::ves::Opt_BachAveragedSGD
, PLMD::ves::Opt_Dummy
, PLMD::ves::Opt_RobbinsMonroSGD
, PLMD::ves::Optimizer
, PLMD::ves::OutputBasisFunctions
, PLMD::ves::OutputFesBias
, PLMD::ves::OutputTargetDistribution
, PLMD::ves::TargetDistribution
, PLMD::ves::TD_Chi
, PLMD::ves::TD_ChiSquared
, PLMD::ves::TD_Custom
, PLMD::ves::TD_Exponential
, PLMD::ves::TD_ExponentiallyModifiedGaussian
, PLMD::ves::TD_Gaussian
, PLMD::ves::TD_GeneralizedExtremeValue
, PLMD::ves::TD_GeneralizedNormal
, PLMD::ves::TD_Grid
, PLMD::ves::TD_LinearCombination
, PLMD::ves::TD_Multicanonical
, PLMD::ves::TD_MultithermalMultibaric
, PLMD::ves::TD_ProductCombination
, PLMD::ves::TD_ProductDistribution
, PLMD::ves::TD_Uniform
, PLMD::ves::TD_VonMises
, PLMD::ves::TD_WellTempered
, PLMD::ves::VesBias
, PLMD::ves::VesDeltaF
, PLMD::ves::VesLinearExpansion
, PLMD::vesselbase::ActionWithAveraging
, PLMD::vesselbase::ActionWithInputVessel
, PLMD::vesselbase::ActionWithVessel
, PLMD::vesselbase::AltMin
, PLMD::vesselbase::AveragingVessel
, PLMD::vesselbase::Between
, PLMD::vesselbase::FunctionVessel
, PLMD::vesselbase::Highest
, PLMD::vesselbase::Histogram
, PLMD::vesselbase::LessThan
, PLMD::vesselbase::Lowest
, PLMD::vesselbase::Max
, PLMD::vesselbase::Mean
, PLMD::vesselbase::Min
, PLMD::vesselbase::Moments
, PLMD::vesselbase::MoreThan
, PLMD::vesselbase::OrderingVessel
, PLMD::vesselbase::ShortcutVessel
, PLMD::vesselbase::StoreDataVessel
, PLMD::vesselbase::Sum
, PLMD::vesselbase::ValueVessel
, PLMD::vesselbase::Vessel
- registerTemperingKeywords()
: PLMD::bias::MetaD
- regulariser
: PLMD::dimred::SketchMapSmacof
, PLMD::pamm::HBPammMatrix
, PLMD::pamm::PammObject
- reinitializeIndices()
: PLMD::ves::CoeffsBase
- remarklen
: PLMD::molfile::molfile_metadata_t
- remarks
: PLMD::molfile::molfile_metadata_t
- remove()
: PLMD::ActionRegister
, PLMD::Atoms
, PLMD::CLToolRegister
, PLMD::Keywords
, PLMD::MetricRegister
, PLMD::vesselbase::VesselRegister
- removeCenter()
: PLMD::RMSD
- removeComponent()
: PLMD::Keywords
- removeDuplicates()
: PLMD::Tools
- removeGroup()
: PLMD::Atoms
- removeVirtualAtom()
: PLMD::Atoms
- renameNodeVariables()
: PLMD::lepton::ParsedExpression
- renameVariables()
: PLMD::lepton::ParsedExpression
- reparameterize()
: PLMD::mapping::PathReparameterization
- reparameterizePart()
: PLMD::mapping::PathReparameterization
- replaceLabelString()
: PLMD::ves::CoeffsBase
- replica_
: PLMD::isdb::Caliber
, PLMD::isdb::EMMI
, PLMD::isdb::Metainference
, PLMD::isdb::MetainferenceBase
, PLMD::isdb::Rescale
- replica_averaging()
: PLMD::isdb::Caliber
, PLMD::isdb::Metainference
, PLMD::isdb::MetainferenceBase
- replica_index
: PLMD::Action
- req_vals
: PLMD::analysis::OutputColvarFile
- requestArguments()
: PLMD::ActionWithArguments
- requestAtoms()
: PLMD::ActionAtomistic
, PLMD::ActionWithVirtualAtom
, PLMD::Colvar
, PLMD::multicolvar::VolumeGradientBase
- requestExtraDependencies()
: PLMD::ActionWithArguments
- requestlist_
: PLMD::NeighborList
- res_kind
: PLMD::isdb::CS2Backbone::ChemicalShift
- res_name
: PLMD::isdb::CS2Backbone::ChemicalShift
- res_num
: PLMD::isdb::CS2Backbone::ChemicalShift
, PLMD::isdb::CS2Backbone
- res_type_curr
: PLMD::isdb::CS2Backbone::ChemicalShift
- res_type_next
: PLMD::isdb::CS2Backbone::ChemicalShift
- res_type_prev
: PLMD::isdb::CS2Backbone::ChemicalShift
- Rescale()
: PLMD::isdb::Rescale
- rescaledToBias
: PLMD::BiasRepresentation
- rescaleForces()
: PLMD::MDAtomsBase
, PLMD::MDAtomsTyped< T >
- ReselectLandmarks
: PLMD::analysis::AnalysisBase
, PLMD::analysis::LandmarkSelectionBase
, PLMD::analysis::ReselectLandmarks
- reserve()
: PLMD::Keywords
- reserved()
: PLMD::Keywords
- reserved_keys
: PLMD::Keywords
- reserveFlag()
: PLMD::Keywords
- reserveKeyword()
: PLMD::crystallization::GradientVessel
, PLMD::crystallization::VectorMean
, PLMD::crystallization::VectorSum
, PLMD::mapping::SpathVessel
, PLMD::mapping::TrigonometricPathVessel
, PLMD::mapping::ZpathVessel
, PLMD::vesselbase::AltMin
, PLMD::vesselbase::Between
, PLMD::vesselbase::Highest
, PLMD::vesselbase::Histogram
, PLMD::vesselbase::LessThan
, PLMD::vesselbase::Lowest
, PLMD::vesselbase::Max
, PLMD::vesselbase::Mean
, PLMD::vesselbase::Min
, PLMD::vesselbase::Moments
, PLMD::vesselbase::MoreThan
, PLMD::vesselbase::Sum
- reset()
: PLMD::IFile
, PLMD::vesselbase::AveragingVessel
- reset_period_
: PLMD::fisst::FISST
- reset_statistics()
: PLMD::eds::EDS
- reset_style()
: PLMD::Keywords
- resetActive()
: PLMD::PlumedMain
- resetAveraging()
: PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- resetAveragingCounter()
: PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- resetBiasFileOutput()
: PLMD::ves::VesBias
, PLMD::ves::VesLinearExpansion
- ResetCell()
: PLMD::generic::ResetCell
- resetFesFileOutput()
: PLMD::ves::VesBias
, PLMD::ves::VesLinearExpansion
- resetFesProjFileOutput()
: PLMD::ves::VesBias
- resetOutputFmt()
: PLMD::ves::CoeffsBase
- resetStepOfLastBiasGridUpdate()
: PLMD::ves::LinearBasisSetExpansion
- resetStepOfLastBiasWithoutCutoffGridUpdate()
: PLMD::ves::LinearBasisSetExpansion
- resetStepOfLastFesGridUpdate()
: PLMD::ves::LinearBasisSetExpansion
- resetTargetDistFileOutput()
: PLMD::ves::VesBias
- resetTargetDistProjFileOutput()
: PLMD::ves::VesBias
- resetToDefaultOutputFmt()
: PLMD::GridBase
- resid
: PLMD::molfile::md_atom
, PLMD::molfile::molfile_atom_t
- residue
: PLMD::PDB
- residueNames
: PLMD::generic::DumpAtoms
- residuenames
: PLMD::PDB
- residueNumbers
: PLMD::generic::DumpAtoms
- resize()
: PLMD::analysis::AverageVessel
, PLMD::crystallization::GradientVessel
, PLMD::crystallization::VectorMean
, PLMD::crystallization::VectorSum
, PLMD::gridtools::GridVessel
, PLMD::mapping::TrigonometricPathVessel
, PLMD::Matrix< T >
, PLMD::multicolvar::CatomPack
, PLMD::MultiValue
, PLMD::ReferenceValuePack
, PLMD::vesselbase::BridgeVessel
, PLMD::vesselbase::FunctionVessel
, PLMD::vesselbase::Moments
, PLMD::vesselbase::OrderingVessel
, PLMD::vesselbase::ShortcutVessel
, PLMD::vesselbase::StoreDataVessel
, PLMD::vesselbase::Vessel
- resizeBookeepingArray()
: PLMD::multicolvar::MultiColvarBase
- resizeBuffer()
: PLMD::vesselbase::Vessel
- resizeCoeffs()
: PLMD::ves::CoeffsVector
- resizeDerivatives()
: PLMD::Value
- resizeFunctions()
: PLMD::vesselbase::ActionWithVessel
- resizeIndices()
: PLMD::ves::CoeffsBase
- resizeTemporyMultiValues()
: PLMD::vesselbase::StoreDataVessel
- resizeVectors()
: PLMD::Atoms
- resname
: PLMD::molfile::md_atom
, PLMD::molfile::molfile_atom_t
- restart
: PLMD::Action
, PLMD::drr::UIestimator::UIestimator
, PLMD::PlumedMain
- Restart()
: PLMD::setup::Restart
- restartTargetDistribution()
: PLMD::ves::LinearBasisSetExpansion
- restartTargetDistributions()
: PLMD::ves::VesBias
, PLMD::ves::VesLinearExpansion
- Restraint()
: PLMD::bias::Restraint
- rethrow()
: PLMD::Plumed
- retrieve_only_rotation
: PLMD::RMSDCoreData
- retrieveActiveList()
: PLMD::DynamicList< T >
- retrieveAdjacencyLists()
: PLMD::adjmat::AdjacencyMatrixVessel
- retrieveAtoms()
: PLMD::ActionAtomistic
, PLMD::multicolvar::MultiColvarBase
- retrieveAtomsInCells()
: PLMD::LinkCells
- retrieveAtomsInCluster()
: PLMD::adjmat::ClusterAnalysisBase
, PLMD::adjmat::ClusteringBase
, PLMD::adjmat::ClusterWithSurface
- retrieveCentralAtomPos()
: PLMD::multicolvar::BridgedMultiColvarFunction
- retrieveConnectionValue()
: PLMD::adjmat::ActionWithInputMatrix
- retrieveDerivatives()
: PLMD::vesselbase::StoreDataVessel
- retrieveDomain()
: PLMD::crystallization::InterMolecularTorsions
, PLMD::multicolvar::Torsions
, PLMD::multicolvar::XYTorsion
, PLMD::vesselbase::ActionWithVessel
- retrieveEdgeList()
: PLMD::adjmat::AdjacencyMatrixVessel
- retrieveMatrix()
: PLMD::adjmat::AdjacencyMatrixVessel
- retrieveNeighboringAtoms()
: PLMD::LinkCells
- retrieveSequentialValue()
: PLMD::vesselbase::StoreDataVessel
- retrieveTypeDimensions()
: PLMD::adjmat::AdjacencyMatrixBase
- retrieveValueWithIndex()
: PLMD::vesselbase::StoreDataVessel
- retrieveWeightWithIndex()
: PLMD::vesselbase::StoreDataVessel
- reuse_hd
: PLMD::dimred::SketchMapBase
- reuse_ld
: PLMD::dimred::SketchMapBase
- rev
: PLMD::molfile::md_file
- reweight
: PLMD::bias::MaxEnt
- reweight_factor_
: PLMD::bias::MetaD
- ReweightBase()
: PLMD::bias::ReweightBase
- ReweightBias()
: PLMD::bias::ReweightBias
- ReweightMetad()
: PLMD::bias::ReweightMetad
- ReweightTemperaturePressure()
: PLMD::bias::ReweightTemperaturePressure
- ReweightWham()
: PLMD::bias::ReweightWham
- rewind()
: PLMD::OFile
- rg_type
: PLMD::colvar::Gyration
- rgb3f
: PLMD::molfile::molfile_volumetric_readwrite_t
- rgb3u
: PLMD::molfile::molfile_volumetric_readwrite_t
- RightParen
: PLMD::lepton::ParseToken
- ringInfo
: PLMD::isdb::CS2Backbone
- RingInfo()
: PLMD::isdb::CS2Backbone::RingInfo
- rmsd
: PLMD::colvar::MultiRMSD
, PLMD::colvar::PCARMSD
- RMSD()
: PLMD::colvar::RMSD
- rmsd
: PLMD::colvar::RMSD
, PLMD::generic::FitToTemplate
- RMSD()
: PLMD::RMSD
- RMSDBase()
: PLMD::RMSDBase
- RMSDCoreData()
: PLMD::RMSDCoreData
- rmsdPosClose
: PLMD::colvar::PathMSDBase
- RNMX
: PLMD::Random
- root
: PLMD::generic::Plumed
- root5
: PLMD::gridtools::GridVessel
- root_
: PLMD::Tree
- RootFindingBase()
: PLMD::RootFindingBase< FCLASS >
- rootNode
: PLMD::lepton::ParsedExpression
- roots
: PLMD::generic::WholeMolecules
- rot
: PLMD::ReferenceValuePack
- rotate
: PLMD::generic::Print
- rotateArguments
: PLMD::generic::Print
- rotateCountdown
: PLMD::generic::Print
- rotateLast
: PLMD::generic::Print
- rotation
: PLMD::generic::FitToTemplate
, PLMD::generic::ResetCell
, PLMD::RMSDCoreData
- rotationmatrix
: PLMD::crystallization::CubicHarmonicBase
- rotationPosClose
: PLMD::colvar::PathMSDBase
- rotationRefClose
: PLMD::colvar::PathMSDBase
- round()
: PLMD::drr::UIestimator::n_matrix
- Row()
: PLMD::MatrixSquareBracketsAccess< T, C, I, J >::Row
- rPIV
: PLMD::piv::PIV
- rpress_
: PLMD::bias::ReweightTemperaturePressure
- rr00
: PLMD::RMSDCoreData
- rr11
: PLMD::RMSDCoreData
- rs
: PLMD::sasa::SASA_HASEL
, PLMD::sasa::SASA_LCPO
- rtemp_
: PLMD::bias::ReweightTemperaturePressure
- rtwo
: PLMD::isdb::PRE
- rtype
: PLMD::isdb::CS2Backbone::RingInfo
- run()
: PLMD::CLToolMain
, PLMD::dimred::SMACOF
, PLMD::molfile::molfile_qm_t
- runAllTasks()
: PLMD::vesselbase::ActionWithVessel
- runFinalJobs()
: PLMD::Action
, PLMD::analysis::AnalysisBase
, PLMD::analysis::ReadDissimilarityMatrix
, PLMD::gridtools::ConvertToFES
, PLMD::gridtools::GridPrintingBase
, PLMD::vesselbase::ActionWithAveraging
- runJobsAtEndOfCalculation()
: PLMD::PlumedMain
- running
: PLMD::Stopwatch::Watch
- runTask()
: PLMD::gridtools::ActionWithGrid
, PLMD::vesselbase::ActionWithAveraging
- runtimeptr
: PLMD::lepton::CompiledExpression
- runtitle
: PLMD::molfile::molfile_qm_sysinfo_t
- runtype
: PLMD::molfile::molfile_qm_sysinfo_t
- rw
: PLMD::Matrix< T >