Here is a list of all documented class members with links to the class documentation for each member:
- c -
- c
: t_pargs
, wallcc_t
- c1
: t_xpmelmt
- c2
: t_xpmelmt
- c_labelSize
: gmx::CrystallographicLabels
- c_numEigenRealsPerExperiment
: t_oriresdata
- cACC
: t_mdatoms
- caches
: gmx::HardwareTopology::Machine
- calculate()
: ListedForces
- calculateForces()
: gmx::IForceProvider
, gmx::ForceProviders
- CallbackAfterReduction
: gmx::ObservablesReducerBuilder
- CallbackFromBuilder
: gmx::ObservablesReducerBuilder
- CallbackToRequireReduction
: gmx::ObservablesReducerBuilder
- canUseGpuAwareMpi
: gmx::DevelopmentFeatureFlags
- capacity()
: gmx::FixedCapacityVector< typename, size_t >
, gmx::ArrayRef< typename >
- cast()
: gmx::Any
- castRef()
: gmx::Any
- cell
: gmx_ga2la_t::Entry
- cellAngles_
: gmx::MrcDensityMapHeader
- cellLength_
: gmx::MrcDensityMapHeader
- cellSize
: Nbnxm::Grid::Dimensions
- cellSizeX
: gmx::DomdecOptions
- cellSizeY
: gmx::DomdecOptions
- cellSizeZ
: gmx::DomdecOptions
- cENER
: t_mdatoms
- centerOfMass()
: gmx::Site
- cFREEZE
: t_mdatoms
- cg_gl
: t_state
- cg_p
: t_state
- cgnr
: PreprocessResidue
, MoleculePatch
- changeNumAtoms()
: t_state
- changePairlistRadii()
: nonbonded_verlet_t
, PairlistSets
- charge()
: gmx::SelectionPosition
- chargeA
: t_mdatoms
- chargeB
: t_mdatoms
- charges
: gmx::BenchmarkSystem
, gmx::Selection
- checkAbilityDependencies()
: gmx::IOutputAdapter
, gmx::OutputSelector
, gmx::SetAtoms
, gmx::SetBox
, gmx::SetForces
, gmx::SetPrecision
, gmx::SetStartTime
, gmx::SetTimeStep
, gmx::SetVelocities
- checkAny()
: gmx::test::TestReferenceChecker
- checkBoolean()
: gmx::test::TestReferenceChecker
- checkChar()
: gmx::test::TestReferenceChecker
- checkCompound()
: gmx::test::TestReferenceChecker
- checkDouble()
: gmx::test::TestReferenceChecker
- checkEmptySequence()
: gmx::test::TestReferenceChecker
- checker()
: gmx::test::StringTestBase
- checkFile()
: gmx::test::IFileMatcher
- checkFileContents()
: gmx::test::StringTestBase
- checkFloat()
: gmx::test::TestReferenceChecker
- checkInt32()
: gmx::test::TestReferenceChecker
- checkInt64()
: gmx::test::TestReferenceChecker
- checkInteger()
: gmx::test::TestReferenceChecker
- checkKeyValueTreeObject()
: gmx::test::TestReferenceChecker
- checkKeyValueTreeValue()
: gmx::test::TestReferenceChecker
- checkOutputFiles()
: gmx::test::CommandLineTestHelper
, gmx::test::CommandLineTestBase
- checkpointData()
: gmx::ReadCheckpointDataHolder
, gmx::WriteCheckpointDataHolder
- checkpointedData_
: gmx::MDModulesCheckpointReadingDataOnMain
- CheckpointError()
: gmx::CheckpointError
- CheckpointHandler()
: gmx::CheckpointHandler
- checkpointingNotifier_
: gmx::MDModulesNotifiers
- checkPresent()
: gmx::test::TestReferenceChecker
- checkReal()
: gmx::test::TestReferenceChecker
- checkRealFromString()
: gmx::test::TestReferenceChecker
- checkRedirectedFiles()
: gmx::test::TestFileOutputRedirector
- checkSequence()
: gmx::test::TestReferenceChecker
- checkSequenceArray()
: gmx::test::TestReferenceChecker
- checkSequenceCompound()
: gmx::test::TestReferenceChecker
- checkSession()
: gmx::test::InteractiveTestHelper
- checkStream()
: gmx::test::ITextBlockMatcher
- checkString()
: gmx::test::TestReferenceChecker
- checkText()
: gmx::test::StringTestBase
- checkTextBlock()
: gmx::test::TestReferenceChecker
- checkUChar()
: gmx::test::TestReferenceChecker
- checkUInt32()
: gmx::test::TestReferenceChecker
- checkUInt64()
: gmx::test::TestReferenceChecker
- checkUnusedEntries()
: gmx::test::TestReferenceChecker
- checkValue()
: gmx::test::TestReferenceChecker
- checkVector()
: gmx::test::TestReferenceChecker
- ci
: NbnxnPairlistCpu
- ciOuter
: NbnxnPairlistCpu
- cj
: nbnxn_cj_t
, nbnxn_cj_packed_t
, NbnxnPairlistCpu
, NbnxnPairlistCpuWork
, JClusterList
, PackedJClusterList
- cjOuter
: NbnxnPairlistCpu
- cjPackedBegin
: nbnxn_sci
- cjPackedEnd
: nbnxn_sci
- classId
: gmx::HardwareTopology::Device
- clear()
: gmx_ga2la_t
, gmx::HashedMap< T >
, gmx::PaddedVector< T, Allocator >
, gmx::UpdateGroupsCog
, SystemMomentum
, gmx::TextTableFormatter
, gmx::RestraintManager
, gmx::FixedCapacityVector< typename, size_t >
, gmx::MessageStringCollector
, gmx::AnalysisDataValue
, gmx::RangePartitioning
, gmx::FlagsTemplate< FlagType >
, gmx::ListOfLists< typename >
- clearAll()
: gmx::FlagsTemplate< FlagType >
- clearAndResizeHashTable()
: gmx::HashedMap< T >
- clearFlag()
: gmx::AbstractOptionStorage
, gmx::AbstractOption
- clearGpuFBufferEarly
: gmx::StepWorkload
- clearSet()
: gmx::AbstractOptionStorage
, gmx::OptionStorageTemplate< T >
- ClfftInitializer()
: gmx::ClfftInitializer
- ClHandle()
: gmx::ClHandle< cl_type >
- clone()
: gmx::AbstractAverageHistogram
- cloneOnSpawnedThread()
: gmx::Mdrunner
- close()
: gmx::StandardInputStream
, gmx::TextInputFile
, gmx::TextOutputFile
, gmx::StringOutputStream
, gmx::StringInputStream
, gmx::TextReader
, gmx::TextInputStream
, gmx::TextOutputStream
, gmx::TextWriter
- closeAfterForceComputationCpu()
: DDBalanceRegionHandler
- closeAfterForceComputationGpu()
: DDBalanceRegionHandler
- closeTimingRegion()
: GpuRegionTimerWrapper< GpuRegionTimerImpl >
, GpuRegionTimerImpl
- CMainFunction
: gmx::CommandLineModuleManager
- cmakeGridSpacing
: InteractionsOfType
- cmap
: InteractionsOfType
- cmap_grid
: gmx_ffparams_t
- cmapAngles
: InteractionsOfType
- cmapAtomTypes
: InteractionsOfType
- code
: t_mapping
- cog()
: gmx::UpdateGroupsCog
- cogForAtom()
: gmx::UpdateGroupsCog
- cogIndex()
: gmx::UpdateGroupsCog
- collectiveIndex()
: gmx::LocalAtomSet
- columnCount()
: gmx::AnalysisDataPointSetRef
, gmx::AnalysisDataStorageFrame
, gmx::test::AnalysisDataTestInput
, gmx::AbstractAnalysisData
- columnRowSectionStart_
: gmx::MrcDensityMapHeader
- columnRowSectionToXyz_
: gmx::MrcDensityMapHeader
- combineMtsForcesBeforeHaloExchange
: gmx::StepWorkload
- comm_
: gmx::PhysicalNodeCommunicator
- CommandLine()
: gmx::test::CommandLine
- commandLine()
: gmx::CommandLineProgramContext
, gmx::test::CommandLineTestBase
, gmx::IProgramContext
- CommandLineHelpContext()
: gmx::CommandLineHelpContext
- CommandLineHelpWriter()
: gmx::CommandLineHelpWriter
- CommandLineModuleManager()
: gmx::CommandLineModuleManager
- CommandLineParser()
: gmx::CommandLineParser
- CommandLineProgramContext()
: gmx::CommandLineProgramContext
- CommandLineTestHelper()
: gmx::test::CommandLineTestHelper
- commGuard_
: gmx::PhysicalNodeCommunicator
- commitValues()
: gmx::OptionStorageTemplate< T >
- commRec_
: gmx::SimulatorEnv
- communicateHaloCoordinates()
: gmx::GpuHaloExchange
- communicateHaloForces()
: gmx::GpuHaloExchange
- communicationBuffer()
: gmx::ObservablesReducer
- communicator_
: gmx::MDModulesCheckpointReadingBroadcast
- compile()
: gmx::SelectionCollection
- completeDefaultFileName()
: gmx::FileNameOptionManager
- completeFileName()
: gmx::FileNameOptionManager
- compressed_symmetric
: gmx_sparsematrix
- computeDhdl
: gmx::StepWorkload
- computeEnergy
: gmx::StepWorkload
- computeForces
: gmx::StepWorkload
- computeListedForces
: gmx::StepWorkload
- computeMuTot
: gmx::SimulationWorkload
- computeNonbonded
: gmx::SimulationWorkload
- computeNonbondedAtMtsLevel1
: gmx::SimulationWorkload
- computeNonbondedForces
: gmx::StepWorkload
- computePmeOnSeparateRank
: gmx::StepWorkload
- computeSlowForces
: gmx::StepWorkload
- computeVirial
: gmx::StepWorkload
, gmx::ForceWithShiftForces
- computeVirial_
: gmx::ForceWithVirial
- const_iterator
: gmx::ArrayRef< typename >
, gmx::MultiDimArray< TContainer, Extents, LayoutPolicy >
, gmx::FixedCapacityVector< typename, size_t >
, gmx::ArrayRefWithPadding< typename >
- const_pointer
: gmx::FixedCapacityVector< typename, size_t >
, gmx::ArrayRef< typename >
, gmx::ArrayRefWithPadding< typename >
- const_reference
: gmx::MultiDimArray< TContainer, Extents, LayoutPolicy >
, gmx::FixedCapacityVector< typename, size_t >
, gmx::ArrayRef< typename >
- const_reverse_iterator
: gmx::ArrayRef< typename >
, gmx::FixedCapacityVector< typename, size_t >
- const_view_type
: gmx::MultiDimArray< TContainer, Extents, LayoutPolicy >
- constantEnsembleTemperature_
: gmx::EnsembleTemperature
- constArrayRefFromArray()
: gmx::ArrayRef< typename >
- constArrayRefWithPadding()
: gmx::ArrayRefWithPadding< typename >
, gmx::PaddedVector< T, Allocator >
- constr
: gmx::ConstraintsParam
- constraint_distance_squared
: gmx::shakedata
- constraintCommunicationRange
: gmx::DomdecOptions
- ConstraintsParam()
: gmx::ConstraintsParam
- construct()
: gmx::DefaultInitializationAllocator< T, A >
, gmx::VirtualSitesHandler
, PairlistSets
, gmx::DefaultInitializationAllocator< T, A >
- constructPairlist()
: nonbonded_verlet_t
- constView()
: gmx::MrcDensityMapOfFloatReader
, gmx::GaussTransform3D
- contains()
: gmx::test::CommandLine
- context()
: gmx::DeviceStreamManager
- convert()
: gmx::OptionValueConverterSimple< OutType >
- convertCoordinates()
: nonbonded_verlet_t
- convertCoordinatesGpu()
: nonbonded_verlet_t
- ConverterType
: gmx::OptionStorageTemplateSimple< T >
- convertFrame()
: gmx::ProcessFrameConversion
, gmx::IFrameConverter
- convertOptionValue()
: gmx::SelectionOptionManager
- convertValue()
: gmx::AbstractOptionStorage
, gmx::OptionStorageTemplate< T >
- coordinate_
: gmx::GaussianSpreadKernelParameters::PositionAndAmplitude
- coordinates
: gmx::BenchmarkSystem
, gmx::Selection
- copyAtoms()
: gmx::TopologyInformation
- copyContents()
: gmx::AbstractAnalysisArrayData
- copyright()
: gmx::BinaryInformationSettings
- copyToLegacySymtab()
: StringTable
- coreIdInPackage
: gmx::CpuInfo::LogicalProcessor
- coreRankInPackage
: gmx::HardwareTopology::LogicalProcessor
- cores
: gmx::HardwareTopology::Package
- cORF
: t_mdatoms
- count()
: gmx_ana_pos_t
, nbnxn_cycle_t
- Count
: ListedForces
- counter_type
: gmx::ThreeFry2x64General< rounds, internalCounterBits >
- countRestraints()
: gmx::RestraintManager
- coveredFraction()
: gmx::Selection
- cp0
: NbnxnPairlistCpu
, NbnxnPairlistCpuWork
, PairsearchWork
- cp1
: NbnxnPairlistCpuWork
, PairsearchWork
, NbnxnPairlistCpu
- cpuLimit()
: gmx::HardwareTopology
- cr_
: gmx::ForceProviderInput
- create()
: gmx::NonbondedBenchmarkInfo
, gmx::DensityFittingModuleInfo
, gmx::RestraintMDModule
, gmx::ConvertTprInfo
, gmx::Any
- createArray()
: gmx::KeyValueTreeValueBuilder
- createFileMatcher()
: gmx::test::TextFileMatch
, gmx::test::NoContentsMatch
, gmx::test::IFileMatcherSettings
- createMatcher()
: gmx::test::NoTextMatch
, gmx::test::FilteringExactTextMatch
, gmx::test::XvgMatch
, gmx::test::ExactTextMatch
, gmx::test::ITextBlockMatcherSettings
, gmx::test::ConfMatch
- createModule()
: gmx::TrajectoryAnalysisCommandLineRunner
, gmx::ICommandLineOptionsModule
- createObject()
: gmx::KeyValueTreeValueBuilder
- createStorage()
: gmx::AbstractOptionSection
, gmx::AbstractOption
- createTrajectoryFrameWriter
: gmx::TrajectoryFrameWriter
- cross()
: gmx::BasicVector< ValueType >
- csv
: gmx::BenchmarkSystem
- cTC
: t_mdatoms
- cU1
: t_mdatoms
- cU2
: t_mdatoms
- CubicSplineTable()
: gmx::CubicSplineTable
- currentFrame()
: gmx::AnalysisDataStorage
- cVCM
: t_mdatoms
- cycleCounter
: PairsearchWork
- cycleCounting_
: PairSearch