- s -
- S2ContactModel()
: PLMD::s2cm::S2ContactModel
- SafePtr()
: PLMD::Plumed::SafePtr
- sameShape()
: PLMD::ves::CoeffsBase
, PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- sampling_radius()
: PLMD::maze::Optimizer
- sasa_calculate()
: PLMD::isdb::SAXS
- SASA_HASEL()
: PLMD::sasa::SASA_HASEL
- SASA_LCPO()
: PLMD::sasa::SASA_LCPO
- savePositions()
: PLMD::GREX
- saveValueAsDouble()
: PLMD::DataPassingObject
, PLMD::DataPassingObjectTyped< T >
- SAXS()
: PLMD::isdb::SAXS
- scaleAllValues()
: PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- scaleAllValuesAndDerivatives()
: PLMD::Grid
- scaledToReal()
: PLMD::Pbc
- scaleEnergy()
: PLMD::isdb::EMMI
- scanField()
: PLMD::IFile
- scanFieldList()
: PLMD::IFile
- scanOneHill()
: PLMD::bias::MetaD
, PLMD::bias::PBMetaD
, PLMD::function::FilesHandler
- score()
: PLMD::maze::Optimizer
- score_mean()
: PLMD::maze::Memetic
- score_member()
: PLMD::maze::Memetic
- score_members()
: PLMD::maze::Memetic
- search()
: PLMD::Brent1DRootSearch< FCLASS >
- Sec()
: PLMD::lepton::Operation
- SecondaryStructureRMSD()
: PLMD::secondarystructure::SecondaryStructureRMSD
- select()
: PLMD::ActionSet
- Select()
: PLMD::isdb::Select
, PLMD::lepton::Operation
- SelectComponents()
: PLMD::valtools::SelectComponents
- selection_roulette()
: PLMD::maze::Memetic
- selectLatest()
: PLMD::ActionSet
- SelectMassCharge()
: PLMD::colvar::SelectMassCharge
- selectNot()
: PLMD::ActionSet
- Selector()
: PLMD::isdb::MetainferenceBase
, PLMD::isdb::Selector
- selectWithLabel()
: PLMD::ActionSet
- SelectWithMask()
: PLMD::valtools::SelectWithMask
- serial()
: PLMD::AtomNumber
- set()
: PLMD::gch::detail::small_vector_data_base< Pointer, SizeT >
, PLMD::HistogramBead
, PLMD::LeptonCall
, PLMD::RMSD
, PLMD::SwitchingFunction
, PLMD::TypesafePtr
, PLMD::Value
, PLMD::ves::FermiSwitchingFunction
- set_capacity()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
, PLMD::gch::detail::small_vector_data_base< Pointer, SizeT >
, PLMD::maze::Memetic
- set_cauchy_mean()
: PLMD::maze::Memetic
- set_cauchy_spread()
: PLMD::maze::Memetic
- set_coding_len()
: PLMD::maze::Memetic
- Set_comm()
: PLMD::ActionForInterface
, PLMD::ActionToPutData
, PLMD::Communicator
, PLMD::DomainDecomposition
- set_data()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
- set_data_ptr()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
, PLMD::gch::detail::small_vector_data_base< Pointer, SizeT >
- set_default()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
- set_distance()
: PLMD::metatensor::vesin::cpu::GrowableNeighborList
- Set_fcomm()
: PLMD::Communicator
- set_label()
: PLMD::maze::Optimizer
- set_local_search_rate()
: PLMD::maze::Memetic
- set_local_search_type()
: PLMD::maze::Memetic
- set_mating_rate()
: PLMD::maze::Memetic
- set_memory()
: PLMD::ActionToGetData
- set_mutation_rate()
: PLMD::maze::Memetic
- set_n_global_iterations()
: PLMD::maze::Memetic
- set_n_iterations()
: PLMD::maze::Optimizer
- set_n_local_iterations()
: PLMD::maze::Memetic
- set_n_threads_openmp()
: PLMD::maze::Optimizer
- set_nl_cutoff()
: PLMD::maze::Optimizer
- set_nl_stride()
: PLMD::maze::Optimizer
- set_opt()
: PLMD::maze::Optimizer
- set_opt_value()
: PLMD::maze::Optimizer
- set_optimizer_stride()
: PLMD::maze::Optimizer
- set_pair()
: PLMD::metatensor::vesin::cpu::GrowableNeighborList
- set_rank_openmp()
: PLMD::maze::Optimizer
- set_sampling_radius()
: PLMD::maze::Optimizer
- set_shift()
: PLMD::metatensor::vesin::cpu::GrowableNeighborList
- set_size()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
, PLMD::gch::detail::small_vector_data_base< Pointer, SizeT >
- set_stride_openmp()
: PLMD::maze::Optimizer
- set_to_inline_storage()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
- set_to_zero()
: PLMD::Tools
- set_value()
: PLMD::drr::UIestimator::n_matrix
, PLMD::drr::UIestimator::n_vector< T >
- set_vector()
: PLMD::metatensor::vesin::cpu::GrowableNeighborList
- setAlign()
: PLMD::RMSD
- setAllCoeffsDescriptions()
: PLMD::ves::CoeffsBase
- setAllCoeffsSetIterationCounters()
: PLMD::ves::Optimizer
- setAllDimensionLabels()
: PLMD::ves::CoeffsBase
- setAllUniformIntegralsToZero()
: PLMD::ves::BasisFunctions
- setAllValuesToZero()
: PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- setArgDerivatives()
: PLMD::isdb::EMMI
, PLMD::isdb::MetainferenceBase
- setArgumentNames()
: PLMD::PDB
- setArgumentValue()
: PLMD::PDB
- setAtomNumbers()
: PLMD::PDB
- setAtomPositions()
: PLMD::PDB
- setAtomsContiguous()
: PLMD::DomainDecomposition
- setAtomsDerivatives()
: PLMD::ActionWithVirtualAtom
, PLMD::Colvar
, PLMD::isdb::EMMI
, PLMD::isdb::MetainferenceBase
- setAtomsGatindex()
: PLMD::DomainDecomposition
- setAtomsNlocal()
: PLMD::DomainDecomposition
- setBackupString()
: PLMD::OFile
- setBias()
: PLMD::bias::Bias
- setBiasGridNeeded()
: PLMD::ves::TargetDistribution
- setBiasMaximumToZero()
: PLMD::ves::LinearBasisSetExpansion
- setBiasMinimumToZero()
: PLMD::ves::LinearBasisSetExpansion
- setBiasOutputStride()
: PLMD::ves::Optimizer
- setBiasWithoutCutoffGridNeeded()
: PLMD::ves::TargetDistribution
- setBounds()
: PLMD::CheckInRange
, PLMD::gridtools::GridCoordinatesObject
- setBox()
: PLMD::Pbc
- setBoxDerivatives()
: PLMD::ActionWithVirtualAtom
, PLMD::Colvar
, PLMD::isdb::EMMI
, PLMD::isdb::MetainferenceBase
- setBoxDerivativesNoPbc()
: PLMD::ActionWithVirtualAtom
, PLMD::Colvar
- setCalcData()
: PLMD::isdb::MetainferenceBase
- setCharge()
: PLMD::ActionWithVirtualAtom
, PLMD::Units
- setCoeffDescription()
: PLMD::ves::CoeffsBase
- setCol()
: PLMD::TensorGeneric< n, m >
- setCollectEnergy()
: PLMD::PlumedMain::DeprecatedAtoms
- setComponentsIntroduction()
: PLMD::Keywords
- setConstant()
: PLMD::Value
- setCurrentBiasMaxValue()
: PLMD::ves::VesBias
- setCurrentStepSize()
: PLMD::ves::Optimizer
- setCurrentStepSizes()
: PLMD::ves::Optimizer
- setCutoff()
: PLMD::LinkCells
- setData()
: PLMD::DataPassingObject
, PLMD::DataPassingObjectTyped< T >
, PLMD::KernelFunctions
- setDataLabel()
: PLMD::ves::CoeffsBase
- setDerivative()
: PLMD::function::Function
, PLMD::MultiValue
, PLMD::Value
- setDerivativeIsZeroWhenValueIsZero()
: PLMD::Value
- setDerivatives()
: PLMD::isdb::EMMI
, PLMD::isdb::MetainferenceBase
- setDescription()
: PLMD::ves::BasisFunctions
- setDimension()
: PLMD::ves::TargetDistribution
- setDimensionLabel()
: PLMD::ves::CoeffsBase
- setDisplace()
: PLMD::RMSD
- setDisplayName()
: PLMD::Keywords
- setDomain()
: PLMD::Value
- setDynamic()
: PLMD::ves::TargetDistribution
- setEndPlumed()
: PLMD::PlumedMain
- setEnergy()
: PLMD::Units
- setEnergyValue()
: PLMD::PlumedMain
- setExchangeStep()
: PLMD::PlumedMain
- setExtraCV()
: PLMD::ActionAtomistic
- setFesGridNeeded()
: PLMD::ves::TargetDistribution
- setFesOutputStride()
: PLMD::ves::Optimizer
- setFesProjOutputStride()
: PLMD::ves::Optimizer
- setFlag()
: PLMD::ExchangePatterns
- setForcedNormalization()
: PLMD::ves::TargetDistribution
- setForcePointer()
: PLMD::ActionForInterface
, PLMD::ActionToPutData
, PLMD::DataPassingObject
, PLMD::DataPassingObjectTyped< T >
, PLMD::DomainDecomposition
- setForcesOnAtoms()
: PLMD::ActionAtomistic
- setForcesOnCell()
: PLMD::ActionAtomistic
- setForceUnit()
: PLMD::DataPassingObject
- setFromVector()
: PLMD::Matrix< T >
- setFullPath()
: PLMD::ActionOptions
- setGlobalPosition()
: PLMD::ActionAtomistic
- setGradients()
: PLMD::ActionWithArguments
, PLMD::Value
- setGradientsIfNeeded()
: PLMD::ActionForInterface
, PLMD::ActionWithValue
- setGridBins()
: PLMD::ves::LinearBasisSetExpansion
, PLMD::ves::VesBias
- setGridDerivatives()
: PLMD::Value
- setGridElement()
: PLMD::gridtools::GridSearch< FCLASS >
- setGridMax()
: PLMD::ves::VesBias
- setGridMin()
: PLMD::ves::VesBias
- setHeavyFlush()
: PLMD::FileBase
- setIndex()
: PLMD::AtomNumber
- setInputData()
: PLMD::CLTool
- setInputForce()
: PLMD::PlumedMain
- setInputValue()
: PLMD::PlumedMain
- setInterval()
: PLMD::ves::BasisFunctions
- setIntervalBounded()
: PLMD::ves::BasisFunctions
- setIntervalNonBounded()
: PLMD::ves::BasisFunctions
- setIntrinsicInterval()
: PLMD::ves::BasisFunctions
- setIterationCounter()
: PLMD::ves::CoeffsBase
, PLMD::ves::Optimizer
- setIterationCounterAndTime()
: PLMD::ves::CoeffsBase
- setKernelType()
: PLMD::HistogramBead
- setLabel()
: PLMD::ves::BasisFunctions
, PLMD::ves::CoeffsBase
- setLabelPrefix()
: PLMD::ves::BasisFunctions
- setLabels()
: PLMD::ves::BasisFunctions
, PLMD::ves::CoeffsBase
- setLastUpdate()
: PLMD::NeighborList
- setLength()
: PLMD::Units
- setLinePrefix()
: PLMD::OFile
- setLinkCellCutoff()
: PLMD::adjmat::AdjacencyMatrixBase
- setMass()
: PLMD::ActionWithVirtualAtom
, PLMD::Units
- setMatrixBookeepingElement()
: PLMD::Value
- setMatrixBookeepingStart()
: PLMD::Value
- setMetaDer()
: PLMD::isdb::MetainferenceBase
- setMinimumOfTargetDistGridToZero()
: PLMD::ves::TargetDistribution
- setMinToZero()
: PLMD::Grid
- setMissingKey()
: PLMD::ExceptionRegisterError
- setNarg()
: PLMD::isdb::MetainferenceBase
- setNelemAndShape()
: PLMD::TypesafePtr
- setNofR()
: PLMD::ExchangePatterns
- setNonPeriodic()
: PLMD::ves::BasisFunctions
- setNotPeriodic()
: PLMD::ActionWithValue
, PLMD::Value
- setNumberOfBasisFunctions()
: PLMD::ves::BasisFunctions
- setNumberOfIndices()
: PLMD::MultiValue
- setNumberOfMatrixRowDerivatives()
: PLMD::MultiValue
- setNumericalIntegrationBins()
: PLMD::ves::BasisFunctions
- setOperation()
: PLMD::lepton::ExpressionProgram
- setOption()
: PLMD::Action
- setOrder()
: PLMD::ves::BasisFunctions
- setOutputFmt()
: PLMD::GridBase
, PLMD::ves::CoeffsBase
- setOutputForce()
: PLMD::bias::Bias
- setParallel()
: PLMD::ves::LinearBasisSetExpansion
- setParameter()
: PLMD::isdb::MetainferenceBase
- setParameters()
: PLMD::isdb::MetainferenceBase
- setPbc()
: PLMD::PbcAction
- setPeriodic()
: PLMD::ActionWithValue
, PLMD::ves::BasisFunctions
- setPeriodicityForOutputs()
: PLMD::function::FunctionTemplateBase
, PLMD::function::Moments
, PLMD::function::Piecewise
, PLMD::function::Sort
, PLMD::refdist::Difference
, PLMD::symfunc::CylindricalHarmonic
, PLMD::symfunc::SphericalHarmonic
- setPosition()
: PLMD::ActionWithVirtualAtom
- setPositionInMatrixStash()
: PLMD::Value
- setPositions()
: PLMD::PDB
- setPositionsCenter()
: PLMD::RMSDCoreData
- setPositionsCenterIsRemoved()
: PLMD::RMSDCoreData
- setPrefactor()
: PLMD::function::FunctionTemplateBase
, PLMD::function::Sum
- setReference()
: PLMD::ERMSD
, PLMD::RMSD
- setReferenceCenter()
: PLMD::RMSDCoreData
- setReferenceCenterIsRemoved()
: PLMD::RMSDCoreData
- setReferenceConfiguration()
: PLMD::mapping::PathProjectionCalculator
- setReferenceConfigurations()
: PLMD::colvar::RMSDVector
- setRemainingToDefault()
: PLMD::CLTool
- setRequestList()
: PLMD::NeighborList
- setRescaledToBias()
: PLMD::BiasRepresentation
- setRestart()
: PLMD::PlumedMain
- setRow()
: PLMD::TensorGeneric< n, m >
- setScore()
: PLMD::isdb::MetainferenceBase
- setSecondTaskIndex()
: PLMD::MultiValue
- setSeed()
: PLMD::ExchangePatterns
, PLMD::Random
- setSerial()
: PLMD::AtomNumber
, PLMD::ves::LinearBasisSetExpansion
- setShape()
: PLMD::Value
- setSplitIndex()
: PLMD::MultiValue
- setStart()
: PLMD::ActionForInterface
, PLMD::ActionToPutData
, PLMD::DataPassingObject
, PLMD::DomainDecomposition
- setStatic()
: PLMD::ves::TargetDistribution
- setStepOfLastBiasGridUpdate()
: PLMD::ves::LinearBasisSetExpansion
- setStepOfLastBiasWithoutCutoffGridUpdate()
: PLMD::ves::LinearBasisSetExpansion
- setStepOfLastFesGridUpdate()
: PLMD::ves::LinearBasisSetExpansion
- setStepSize()
: PLMD::ves::Optimizer
- setStepSizes()
: PLMD::ves::Optimizer
- setStride()
: PLMD::ActionForInterface
, PLMD::ActionPilot
, PLMD::ActionToPutData
, PLMD::DataPassingObject
, PLMD::DomainDecomposition
- setStyle()
: PLMD::Keywords::KeyType
- setSuffix()
: PLMD::PlumedMain
- setSymmetric()
: PLMD::Value
- setTargetDistAverages()
: PLMD::ves::VesBias
- setTargetDistAveragesToZero()
: PLMD::ves::VesBias
- setTargetDistOutputStride()
: PLMD::ves::Optimizer
- setTargetDistProjOutputStride()
: PLMD::ves::Optimizer
- setTaskIndex()
: PLMD::MultiValue
- setTime()
: PLMD::Units
, PLMD::ves::CoeffsBase
- setType()
: PLMD::RMSD
, PLMD::ves::BasisFunctions
, PLMD::ves::CoeffsBase
- setUniformIntegral()
: PLMD::ves::BasisFunctions
- setUniformIntegrals()
: PLMD::ves::BasisFunctions
- setUnit()
: PLMD::ActionToPutData
, PLMD::DataPassingObject
- setUnits()
: PLMD::PlumedMain
- setup()
: PLMD::function::FunctionTemplateBase
, PLMD::gridtools::EvaluateGridFunction
, PLMD::gridtools::GridCoordinatesObject
- setupAdditionalGrids()
: PLMD::ves::TargetDistribution
, PLMD::ves::TD_Custom
, PLMD::ves::TD_LinearCombination
, PLMD::ves::TD_ProductCombination
, PLMD::ves::TD_ProductDistribution
, PLMD::ves::TD_Uniform
- setupBasisFunctionsInfo()
: PLMD::ves::CoeffsBase
- setupBF()
: PLMD::ves::BasisFunctions
- setupBiasCutoff()
: PLMD::ves::TargetDistribution
, PLMD::ves::VesBias
- setupBiasFileOutput()
: PLMD::ves::VesBias
, PLMD::ves::VesLinearExpansion
- setupBiasGrid()
: PLMD::ves::LinearBasisSetExpansion
- setupConstants()
: PLMD::colvar::EEFSolv
- setupConstantValues()
: PLMD::Action
- setupExponentiallyDecayingAveraging()
: PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- setupFesFileOutput()
: PLMD::ves::VesBias
, PLMD::ves::VesLinearExpansion
- setupFesGrid()
: PLMD::ves::LinearBasisSetExpansion
- setupFesProjFileOutput()
: PLMD::ves::VesBias
, PLMD::ves::VesLinearExpansion
- setupFesProjGrid()
: PLMD::ves::LinearBasisSetExpansion
- setupForTask()
: PLMD::ActionWithMatrix
, PLMD::adjmat::AdjacencyMatrixBase
, PLMD::adjmat::Neighbors
, PLMD::adjmat::TorsionsMatrix
, PLMD::crystdistrib::QuaternionBondProductMatrix
, PLMD::crystdistrib::QuaternionProductMatrix
, PLMD::function::FunctionOfMatrix< T >
, PLMD::matrixtools::MatrixTimesMatrix
, PLMD::matrixtools::MatrixTimesVector
, PLMD::matrixtools::OuterProduct
, PLMD::matrixtools::Voronoi
, PLMD::valtools::VStack
- setupGeneralGrid()
: PLMD::ves::LinearBasisSetExpansion
- setupGrid()
: PLMD::ves::WaveletGrid
- setupGrids()
: PLMD::ves::TargetDistribution
- setupHASELparam()
: PLMD::sasa::SASA_HASEL
- setupHistogramBeads()
: PLMD::gridtools::KDE
- setupInterfaceActions()
: PLMD::PlumedMain
- setupInterval()
: PLMD::ves::BasisFunctions
- setupLabels()
: PLMD::ves::BasisFunctions
, PLMD::ves::BF_Combined
, PLMD::ves::BF_Cosine
, PLMD::ves::BF_Fourier
, PLMD::ves::BF_Gaussians
, PLMD::ves::BF_Powers
, PLMD::ves::BF_Sine
, PLMD::ves::BF_Wavelets
- setupLCPOparam()
: PLMD::isdb::SAXS
, PLMD::sasa::SASA_LCPO
- setupMatrices()
: PLMD::ves::WaveletGrid
- setupMatrix()
: PLMD::ves::CoeffsMatrix
- setupMaxSurfMap()
: PLMD::sasa::SASA_HASEL
, PLMD::sasa::SASA_LCPO
- setupNeighborsVector()
: PLMD::gridtools::KDE
- setupOFiles()
: PLMD::ves::Optimizer
- setupOnFirstStep()
: PLMD::contour::ContourFindingBase
, PLMD::fourier::FourierTransform
, PLMD::gridtools::ActionWithGrid
, PLMD::gridtools::FindGridOptimum
, PLMD::gridtools::FunctionOfGrid< T >
, PLMD::gridtools::InterpolateGrid
, PLMD::gridtools::KDE
, PLMD::gridtools::ReadGridInSetup
- setupOutObservable()
: PLMD::fisst::FISST
- setupOutRestart()
: PLMD::eds::EDS
, PLMD::fisst::FISST
- setupPeriodicity()
: PLMD::Value
- setupPrintValue()
: PLMD::OFile
- setupRegions()
: PLMD::volumes::ActionVolume
, PLMD::volumes::VolumeAround
, PLMD::volumes::VolumeCavity
, PLMD::volumes::VolumeInCylinder
, PLMD::volumes::VolumeInEnvelope
, PLMD::volumes::VolumeInSphere
, PLMD::volumes::VolumeTetrapore
- setupStreamedComponents()
: PLMD::ActionWithMatrix
, PLMD::ActionWithVector
, PLMD::colvar::MultiColvarTemplate< T >
, PLMD::function::FunctionOfMatrix< T >
, PLMD::function::FunctionOfVector< T >
- setupStretch()
: PLMD::switchContainers::baseSwitch
- setupTargetDistFileOutput()
: PLMD::ves::VesBias
- setupTargetDistPntr()
: PLMD::ves::OutputBasisFunctions
- setupTargetDistProjFileOutput()
: PLMD::ves::VesBias
- setupTargetDistribution()
: PLMD::ves::LinearBasisSetExpansion
- setupThirdAtomBlock()
: PLMD::adjmat::AdjacencyMatrixBase
- setupTypeMap()
: PLMD::colvar::EEFSolv
- setupUniformIntegrals()
: PLMD::ves::BasisFunctions
, PLMD::ves::BF_Chebyshev
, PLMD::ves::BF_Combined
, PLMD::ves::BF_Cosine
, PLMD::ves::BF_Fourier
, PLMD::ves::BF_Legendre
, PLMD::ves::BF_Sine
- setupUniformTargetDistribution()
: PLMD::ves::LinearBasisSetExpansion
- setupValueMap()
: PLMD::colvar::EEFSolv
- setupValuesOnFirstStep()
: PLMD::contour::ContourFindingBase
, PLMD::contour::FindContour
, PLMD::contour::FindContourSurface
, PLMD::contour::FindSphericalContour
- setValType()
: PLMD::Value
- setValue()
: PLMD::ActionWithValue
, PLMD::Grid
, PLMD::GridBase
, PLMD::MultiValue
, PLMD::SparseGrid
, PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- setValueAndDerivatives()
: PLMD::Grid
, PLMD::GridBase
, PLMD::SparseGrid
- setValueDescription()
: PLMD::Keywords
- setValuePointer()
: PLMD::ActionForInterface
, PLMD::ActionToPutData
, PLMD::DataPassingObject
, PLMD::DataPassingObjectTyped< T >
, PLMD::DomainDecomposition
- setValues()
: PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- setValuesFromDifferentShape()
: PLMD::ves::CoeffsVector
- setVariableLocations()
: PLMD::lepton::CompiledExpression
- setWeight()
: PLMD::dimred::SMACOF
- sgn()
: PLMD::logmfd::LogMFD
, PLMD::maze::tls
- Shadow()
: PLMD::isdb::Shadow
- shapeOfIndices()
: PLMD::ves::CoeffsBase
- share()
: PLMD::ActionForInterface
, PLMD::ActionToPutData
, PLMD::DomainDecomposition
- share_data()
: PLMD::DataPassingObject
, PLMD::DataPassingObjectTyped< T >
- shareAll()
: PLMD::ActionForInterface
, PLMD::ActionToPutData
, PLMD::DomainDecomposition
, PLMD::PlumedMain
- shareData()
: PLMD::PlumedMain
- shift_into_uninitialized()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
- shortcutKeywords()
: PLMD::multicolvar::MultiColvarShortcuts
, PLMD::symfunc::CoordinationNumbers
- ShowGraph()
: PLMD::cltools::ShowGraph
- shrink_to_fit()
: PLMD::gch::small_vector< T, InlineCapacity, Allocator >
- shrink_to_size()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
- Shuffle()
: PLMD::Random
- side_chain_atoms()
: PLMD::isdb::CS2Backbone
- simpleAlignment()
: PLMD::RMSD
- SimpleMD()
: PLMD::cltools::SimpleMD
- Simulated_Annealing()
: PLMD::maze::Simulated_Annealing
- Sin()
: PLMD::lepton::Operation
- Sinh()
: PLMD::lepton::Operation
- size()
: PLMD::gch::detail::small_vector_data_base< Pointer, SizeT >
, PLMD::gch::small_vector< T, InlineCapacity, Allocator >
, PLMD::Keywords
, PLMD::mdMemoryView< N, STRIDE >
, PLMD::MemoryView< N >
, PLMD::NeighborList
, PLMD::PDB
- SizeLike()
: PLMD::Plumed::SizeLike
, PLMD::TypesafePtr::SizeLike
, PLMD::WithCmd::SizeLike
- SketchMap()
: PLMD::dimred::SketchMap
- SketchMapProjection()
: PLMD::dimred::SketchMapProjection
- SMAC()
: PLMD::symfunc::SMAC
- SMACOF()
: PLMD::dimred::SMACOF
- small_vector()
: PLMD::gch::small_vector< T, InlineCapacity, Allocator >
- small_vector_base()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
- small_vector_data()
: PLMD::gch::detail::small_vector_data< Pointer, SizeT, T, InlineCapacity >
, PLMD::gch::detail::small_vector_data< Pointer, SizeT, T, 0 >
- small_vector_data_base()
: PLMD::gch::detail::small_vector_data_base< Pointer, SizeT >
- small_vector_iterator()
: PLMD::gch::small_vector_iterator< Pointer, DifferenceType >
- smapSwitch()
: PLMD::switchContainers::smapSwitch
- solve()
: PLMD::maze::Memetic
- sort()
: PLMD::LatticeReduction
- sort_members()
: PLMD::maze::Memetic
- SparseGrid()
: PLMD::SparseGrid
- specialSymbol()
: PLMD::MolDataClass
- specificDescription()
: PLMD::switchContainers::baseSwitch
, PLMD::switchContainers::cubicSwitch
, PLMD::switchContainers::fixedRational< N,, >
, PLMD::switchContainers::leptonSwitch
, PLMD::switchContainers::nativeqSwitch
, PLMD::switchContainers::rational< isFast, nis2m >
, PLMD::switchContainers::smapSwitch
- spline()
: PLMD::ves::BF_CubicBsplines
- spline_coeffs()
: PLMD::isdb::SAXS
- splineInterpolation()
: PLMD::gridtools::Interpolator
- Split()
: PLMD::Communicator
- split()
: PLMD::isdb::CS2BackboneDB
- Sprint()
: PLMD::sprint::Sprint
- Sqrt()
: PLMD::lepton::Operation
- Square()
: PLMD::lepton::Operation
- stack()
: PLMD::Exception
- stack_temporary()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >::stack_temporary
- start()
: PLMD::Stopwatch
, PLMD::Stopwatch::Watch
, PLMD::Tools::CriticalSectionWithKey< Key >
- start_step_0()
: PLMD::maze::Optimizer
- start_step_stride()
: PLMD::maze::Optimizer
- startPause()
: PLMD::Stopwatch
, PLMD::Stopwatch::Watch
- startStep()
: PLMD::PlumedMain
- startStop()
: PLMD::Stopwatch
, PLMD::Stopwatch::Watch
, PLMD::Tools::CriticalSectionWithKey< Key >
- startWith()
: PLMD::Tools
- stashMatrixElement()
: PLMD::MultiValue
- Stats()
: PLMD::function::Stats
- std()
: PLMD::maze::tls
- Steered_MD()
: PLMD::maze::Steered_MD
- Steinhardt()
: PLMD::symfunc::Steinhardt
- Step()
: PLMD::lepton::Operation
- StepSize()
: PLMD::ves::Optimizer
- stochastic_hill_climbing()
: PLMD::maze::Memetic
- stop()
: PLMD::PlumedMain
, PLMD::Stopwatch
, PLMD::Stopwatch::Watch
, PLMD::Subprocess
, PLMD::Tools::CriticalSectionWithKey< Key >
- Stopwatch()
: PLMD::Stopwatch
- storage()
: PLMD::gch::detail::small_vector_data< Pointer, SizeT, T, InlineCapacity >
, PLMD::gch::detail::small_vector_data< Pointer, SizeT, T, 0 >
- storage_ptr()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
- stringToType()
: PLMD::ves::WaveletGrid
- stripLeadingAndTrailingBlanks()
: PLMD::Tools
- style()
: PLMD::Keywords
- Subprocess()
: PLMD::Subprocess
- substituteSimplerExpression()
: PLMD::lepton::ParsedExpression
- Subtract()
: PLMD::lepton::Operation
- subtractFromValues()
: PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- Sum()
: PLMD::Communicator
- sumCommMPI()
: PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- sumMultiSimCommMPI()
: PLMD::ves::CoeffsMatrix
, PLMD::ves::CoeffsVector
- sumOverDomains()
: PLMD::DomainDecomposition
- swap()
: PLMD::gch::detail::allocator_inliner< Allocator, false >
, PLMD::gch::detail::allocator_inliner< Allocator, true >
, PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
, PLMD::gch::detail::small_vector_data_base< Pointer, SizeT >
, PLMD::gch::small_vector< T, InlineCapacity, Allocator >
- swap_allocation()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
- swap_capacity()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
, PLMD::gch::detail::small_vector_data_base< Pointer, SizeT >
- swap_data_ptr()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
, PLMD::gch::detail::small_vector_data_base< Pointer, SizeT >
- swap_default()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
- swap_elements()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
- swap_size()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
, PLMD::gch::detail::small_vector_data_base< Pointer, SizeT >
- swap_unequal_no_propagate()
: PLMD::gch::detail::small_vector_base< Allocator, InlineCapacity >
- SwitchingPlotter()
: PLMD::cltools::SwitchingPlotter
- switchTaskReduction()
: PLMD::ActionWithVector