Here is a list of all file members with links to the files they belong to:
- c -
- C1
: SimParameters.h
- C1_MATRIX_SIZE
: MsmMap.h
- C1_VECTOR_SIZE
: MsmMap.h
- C1INDEX
: MsmMap.h
- C2
: SimParameters.h
- Calc_Coul_PairSer()
: ComputeGBISser.C
- Calc_dEda_Pair()
: ComputeGBIS.inl
- Calc_dEda_PairSer()
: ComputeGBISser.C
- Calc_dEdr_Pair()
: ComputeGBIS.inl
- Calc_dEdr_PairSer()
: ComputeGBISser.C
- calc_fulldirect()
: ComputeFullDirect.C
- calc_one_theta()
: CudaPmeSolverUtilKernel.cu
- calc_theta_dtheta()
: CudaPmeSolverUtilKernel.cu
- calcComponentForces()
: ComputeBondedCUDAKernel.cu
- CalcDH()
: ComputeGBIS.inl
- CalcDHPair()
: ComputeGBIS.inl
- CalcDHPairSer()
: ComputeGBISser.C
- CalcDHSer()
: ComputeGBISser.C
- CALCENERGY
: ComputeNonbondedLES.C
, ComputeNonbondedPProf.C
, ComputeNonbondedFEP.C
, ComputeNonbondedPProf.C
, ComputeNonbondedGo.C
, ComputeNonbondedPProf.C
, ComputeNonbondedGo.C
, ComputeNonbondedPProf.C
, ComputeNonbondedStd.C
, ComputeNonbondedGo.C
, ComputeNonbondedStd.C
, ComputeNonbondedGo.C
, ComputeNonbondedStd.C
, ComputeNonbondedGo.C
, ComputeNonbondedStd.C
, ComputeNonbondedGo.C
, ComputeNonbondedStd.C
, ComputeNonbondedGo.C
, ComputeNonbondedTabEnergies.C
, ComputeNonbondedGo.C
, ComputeNonbondedTabEnergies.C
, ComputeNonbondedLES.C
, ComputeNonbondedTabEnergies.C
, ComputeNonbondedLES.C
, ComputeNonbondedTabEnergies.C
, ComputeNonbondedLES.C
, ComputeNonbondedTI.C
- calcForceEnergy()
: CudaComputeNonbondedKernel.cu
- calcGBISPhase()
: CudaComputeGBISKernel.cu
- CalcH()
: ComputeGBIS.inl
- CalcHPair()
: ComputeGBIS.inl
- CalcHPairSer()
: ComputeGBISser.C
- CalcHSer()
: ComputeGBISser.C
- calcOverlap()
: ComputeLCPO.C
- calcPatchNumLists()
: CudaTileListKernel.cu
- CALCPATCHNUMLISTSKERNEL_NUM_THREAD
: CudaTileListKernel.cu
- CalcScaleSer()
: ComputeGBISser.C
- calcTileListPosKernel()
: CudaTileListKernel.cu
- CALCULATE
: Controller.C
- CALCULATE_ANISO
: ComputeAniso.C
- CALCULATE_THOLE_CORRECTION
: ComputeThole.C
- CALL
: ComputeBondedCUDAKernel.cu
, ComputeNonbondedCUDAKernel.cu
, ComputePmeCUDAKernel.cu
, CudaComputeGBISKernel.cu
, CudaComputeNonbondedKernel.cu
, ComputePmeCUDAKernel.cu
- call_sendAtomsToHomePatchProcs()
: ParallelIOMgr.C
- CALLBACKDATA
: Controller.C
- CALLBACKLIST
: Controller.C
- cast_array()
: varsizemsg.h
- cast_size()
: varsizemsg.h
- cbrt
: Controller.C
, Parameters.h
- CcdCallBacksReset()
: ComputeNonbondedCUDA.C
, ComputePme.C
, CudaComputeNonbonded.C
, CudaPmeSolverUtil.C
- cfftb()
: pub3dfft.C
- cfftb1()
: pub3dfft.C
- cfftf()
: pub3dfft.C
- cfftf1()
: pub3dfft.C
- cffti()
: pub3dfft.C
- cffti1()
: pub3dfft.C
- Charge
: NamdTypes.h
- charge
: ComputeNonbondedBase2.h
- chargePool
: CompressPsf.C
- CHDIR
: mainfunc.C
, SimParameters.C
- check_count
: ComputeNonbondedCUDA.C
- CHECK_FEOF
: dcdlib.C
- CHECK_FREAD
: dcdlib.C
- check_local_count
: ComputeNonbondedCUDA.C
- CHECK_PRIORITIES
: ComputeGBIS.C
- check_remote_count
: ComputeNonbondedCUDA.C
- CHECK_REPLICA
: ScriptTcl.C
- CheckParentheses()
: FreeEnergyParse.C
, FreeEnergyParse.h
- checkSum()
: MStream.C
- circShift()
: structures.h
- CKLOOP_CTRL_PME_BACKWARDFFT
: SimParameters.h
- CKLOOP_CTRL_PME_FORWARDFFT
: SimParameters.h
- CKLOOP_CTRL_PME_KSPACE
: SimParameters.h
- CKLOOP_CTRL_PME_SENDTRANS
: SimParameters.h
- CKLOOP_CTRL_PME_SENDUNTRANS
: SimParameters.h
- CKLOOP_CTRL_PME_UNGRIDCALC
: SimParameters.h
- CkpvDeclare()
: ProcessorPrivate.C
- CkpvExtern()
: InfoStream.C
, ProcessorPrivate.h
- CkpvStaticDeclare()
: BackEnd.C
, Communicate.C
- CLASS
: ComputeNonbondedBase.h
- CLASSNAME
: ComputeNonbondedBase.h
- clear_device_array()
: CudaUtils.h
- clear_device_array_async_T()
: CudaUtils.C
, CudaUtils.h
- clear_device_array_sync()
: CudaUtils.h
- clear_device_array_T()
: CudaUtils.C
, CudaUtils.h
- clearGlobalVectors()
: CompressPsf.C
- close_dcd_read()
: dcdlib.C
, dcdlib.h
- close_dcd_write()
: dcdlib.C
, dcdlib.h
- ClusterCoorMsgBuffer
: ParallelIOMgr.h
- ClusterCoorSet
: ParallelIOMgr.h
- ClusterCoorSetIter
: ParallelIOMgr.h
- ClusterSet
: ParallelIOMgr.h
- ClusterSetIter
: ParallelIOMgr.h
- ClusterSizeMsgBuffer
: ParallelIOMgr.h
- CMAP_PHI_0
: ComputeCrossterms.C
- CMAP_PSI_0
: ComputeCrossterms.C
- CMAP_SETUP_DIM
: ComputeCrossterms.C
- CMAP_SPACING
: ComputeCrossterms.C
- CMAP_TABLE_DIM
: ComputeCrossterms.C
- CMPSIGS
: structures.h
- CODE_REDUNDANT
: ComputeNonbondedBase2.h
, GoMolecule.C
, GromacsTopFile.C
, MoleculeQM.C
- COLL_AVG
: LdbCoordinator.C
- COLL_MAX
: LdbCoordinator.C
- COLL_SUM
: LdbCoordinator.C
- COLLECT_PERFORMANCE_DATA
: ParallelIOMgr.h
- COLVARPROXY_VERSION
: colvarproxy_namd_version.h
- compare_bit_reversed()
: ComputePme.C
, WorkDistrib.C
- CompAtomExtList
: NamdTypes.h
- CompAtomList
: NamdTypes.h
- compDistance()
: HomePatch.C
- compLoad()
: ProxyMgr.C
- COMPONENT_DOTPRODUCT
: ComputeNonbondedBase.h
- compress_molecule_info()
: CompressPsf.C
, CompressPsf.h
- COMPRESSED_PSF_MAGICNUM
: CompressPsf.h
- COMPRESSED_PSF_VER
: CompressPsf.h
- compute_b_moduli()
: PmeKSpace.C
- compute_b_spline()
: PmeBase.inl
- COMPUTE_CORRECTION
: Rebalancer.h
- compute_energy_orthogonal_ckloop()
: PmeKSpace.C
- compute_forces_order4_helper()
: PmeRealSpace.C
- COMPUTE_HOME_PRIORITY
: Priorities.h
- COMPUTE_LOAD
: Rebalancer.C
- COMPUTE_PROXY_PRIORITY
: Priorities.h
- COMPUTEANGLE_INL
: ComputeAngles.inl
- computeAnglesType
: ComputeMap.h
- COMPUTEANISO_INL
: ComputeAniso.inl
- computeAnisoType
: ComputeMap.h
- COMPUTEBOND_INL
: ComputeBonds.inl
- computeBondsType
: ComputeMap.h
- computeConsForceType
: ComputeMap.h
- computeConsTorqueType
: ComputeMap.h
- computeCrosstermsType
: ComputeMap.h
- computeCylindricalBCType
: ComputeMap.h
- COMPUTEDIHEDRALS_INL
: ComputeDihedrals.inl
- computeDihedralsType
: ComputeMap.h
- computeEFieldType
: ComputeMap.h
- computeErrorType
: ComputeMap.h
- computeEwaldType
: ComputeMap.h
- computeExclsType
: ComputeMap.h
- computeExtType
: ComputeMap.h
- computeFmmType
: ComputeMap.h
- computeFullDirectType
: ComputeMap.h
- COMPUTEGBIS_INL
: ComputeGBIS.inl
- computeGBISserType
: ComputeMap.h
- computeGlobalType
: ComputeMap.h
- computeGridForceType
: ComputeMap.h
- COMPUTEGROMACSPAIR_INL
: ComputeGromacsPair.inl
- computeGromacsPairType
: ComputeMap.h
- ComputeHomePatchList
: ComputeHomePatches.h
- ComputeID
: NamdTypes.h
- computeImpropersType
: ComputeMap.h
- computeLCPOType
: ComputeMap.h
- ComputeList
: NamdTypes.h
- COMPUTEMAPTAG
: common.h
- COMPUTEMAX
: LdbCoordinator.h
- computeMgr
: ComputeNonbondedCUDA.C
- computeMsmMsaType
: ComputeMap.h
- computeMsmSerialType
: ComputeMap.h
- computeMsmType
: ComputeMap.h
- computeNonbondedCUDA2Type
: ComputeMap.h
- COMPUTENONBONDEDCUDAEXCL_INL
: ComputeNonbondedCUDAExcl.inl
- computeNonbondedCUDAType
: ComputeMap.h
- computeNonbondedMICType
: ComputeMap.h
- computeNonbondedPairType
: ComputeMap.h
- computeNonbondedSelfType
: ComputeMap.h
- computePmeCUDAType
: ComputeMap.h
- computePmeType
: ComputeMap.h
- ComputePtrList
: Patch.h
- ComputePtrListIter
: Patch.C
- computeQMType
: ComputeMap.h
- computeRestraintsType
: ComputeMap.h
- computeSelfAnglesType
: ComputeMap.h
- computeSelfAnisoType
: ComputeMap.h
- computeSelfBondsType
: ComputeMap.h
- computeSelfCrosstermsType
: ComputeMap.h
- computeSelfDihedralsType
: ComputeMap.h
- computeSelfExclsType
: ComputeMap.h
- computeSelfGromacsPairType
: ComputeMap.h
- computeSelfImpropersType
: ComputeMap.h
- computeSelfTholeType
: ComputeMap.h
- computeSphericalBCType
: ComputeMap.h
- computeStirType
: ComputeMap.h
- computeTclBCType
: ComputeMap.h
- COMPUTETHOLE_INL
: ComputeThole.inl
- computeTholeType
: ComputeMap.h
- ComputeType
: ComputeMap.h
- const_exclusions
: ComputeNonbondedCUDAKernel.cu
- constExclusions
: CudaComputeNonbondedKernel.cu
- convert()
: ParseOptions.C
, ParseOptions.h
- convertForces()
: ComputeBondedCUDAKernel.cu
- Coordinate
: NamdTypes.h
- coords
: ScriptTcl.C
- coorType
: Output.h
- copy3D_DtoD()
: CudaUtils.h
- copy3D_DtoD_T()
: CudaUtils.C
, CudaUtils.h
- copy3D_DtoH()
: CudaUtils.h
- copy3D_DtoH_T()
: CudaUtils.C
, CudaUtils.h
- copy3D_HtoD()
: CudaUtils.h
- copy3D_HtoD_T()
: CudaUtils.C
, CudaUtils.h
- copy3D_PeerDtoD()
: CudaUtils.h
- copy3D_PeerDtoD_T()
: CudaUtils.C
, CudaUtils.h
- COPY_ATOM
: ComputeNonbondedCUDAKernel.h
- COPY_ATOM_FROM_SHARED
: ComputeNonbondedCUDAKernel.h
- COPY_ATOM_TO_SHARED
: ComputeNonbondedCUDAKernel.h
- copy_DtoD()
: CudaUtils.h
- copy_DtoD_async_T()
: CudaUtils.C
, CudaUtils.h
- copy_DtoD_sync()
: CudaUtils.h
- copy_DtoD_T()
: CudaUtils.C
, CudaUtils.h
- copy_DtoH()
: CudaUtils.h
- copy_DtoH_async_T()
: CudaUtils.C
, CudaUtils.h
- copy_DtoH_sync()
: CudaUtils.h
- copy_DtoH_T()
: CudaUtils.h
, CudaUtils.C
- copy_HtoD()
: CudaUtils.h
- copy_HtoD_async_T()
: CudaUtils.h
, CudaUtils.C
- copy_HtoD_sync()
: CudaUtils.h
- copy_HtoD_T()
: CudaUtils.h
, CudaUtils.C
- COPY_PARAM
: ComputeNonbondedCUDAKernel.h
- copy_PeerDtoD()
: CudaUtils.h
- copy_PeerDtoD_async_T()
: CudaUtils.h
, CudaUtils.C
- copyTable()
: CudaNonbondedTables.C
- COUL_CONST
: ComputeGBISser.C
- COULOMB
: ComputeGBIS.inl
- coulomb
: ComputeFullDirectBase.h
- COULOMB
: common.h
- count_limit
: ComputePme.C
, ComputeNonbondedCUDA.C
- CPROXY_DE
: DataExchanger.h
- cpuloads
: NamdHybridLB.C
, ProxyMgr.C
, NamdCentLB.C
- cpuTime_start
: BackEnd.C
- CpvDeclare()
: DataExchanger.C
- CpvExtern()
: DataExchanger.h
- createCudaComputeNonbonded()
: ComputeMgr.C
- CreateNamdCentLB()
: NamdCentLB.h
, NamdCentLB.C
- CreateNamdDummyLB()
: NamdDummyLB.C
, NamdDummyLB.h
- CreateNamdHybridLB()
: NamdHybridLB.h
, NamdHybridLB.C
- createStream()
: ComputePmeCUDAMgr.C
- cross()
: ComputeBondedCUDAKernel.cu
- CROSSTERM
: structures.h
- Crossterm
: structures.h
- crossterm_setup()
: ComputeCrossterms.C
, Parameters.C
- crosstermForce()
: ComputeBondedCUDAKernel.cu
- CsmAckHandler()
: Communicate.C
- cSMDPair
: ComputeQM.h
, MoleculeQM.C
- CsmHandler()
: Communicate.C
- CTRL_STK_SZ
: Thread.h
- CUDA
: ComputeNonbondedBase.h
- cuda_affinity_initialize()
: BackEnd.C
, CudaUtils.C
- cuda_args
: DeviceCUDA.C
- cuda_bind_atom_params()
: ComputeNonbondedCUDAKernel.h
, ComputeNonbondedCUDAKernel.cu
- cuda_bind_atoms()
: ComputeNonbondedCUDAKernel.cu
, ComputeNonbondedCUDAKernel.h
- cuda_bind_exclusions()
: ComputeNonbondedCUDAKernel.h
, ComputeNonbondedCUDAKernel.cu
- cuda_bind_force_table()
: ComputeNonbondedCUDAKernel.h
, ComputeNonbondedCUDAKernel.cu
- cuda_bind_forces()
: ComputeNonbondedCUDAKernel.h
, ComputeNonbondedCUDAKernel.cu
- cuda_bind_GBIS_bornRad()
: ComputeNonbondedCUDAKernel.h
, ComputeNonbondedCUDAKernel.cu
- cuda_bind_GBIS_dEdaSum()
: ComputeNonbondedCUDAKernel.h
, ComputeNonbondedCUDAKernel.cu
- cuda_bind_GBIS_dHdrPrefix()
: ComputeNonbondedCUDAKernel.cu
, ComputeNonbondedCUDAKernel.h
- cuda_bind_GBIS_energy()
: ComputeNonbondedCUDAKernel.h
, ComputeNonbondedCUDAKernel.cu
- cuda_bind_GBIS_intRad()
: ComputeNonbondedCUDAKernel.h
, ComputeNonbondedCUDAKernel.cu
- cuda_bind_GBIS_psiSum()
: ComputeNonbondedCUDAKernel.cu
, ComputeNonbondedCUDAKernel.h
- cuda_bind_lj_table()
: ComputeNonbondedCUDAKernel.cu
, ComputeNonbondedCUDAKernel.h
- cuda_bind_patch_pairs()
: ComputeNonbondedCUDAKernel.h
, ComputeNonbondedCUDAKernel.cu
- cuda_bind_vdw_types()
: ComputeNonbondedCUDAKernel.h
, ComputeNonbondedCUDAKernel.cu
- cuda_bind_virials()
: ComputeNonbondedCUDAKernel.cu
, ComputeNonbondedCUDAKernel.h
- CUDA_BONDED_KERNEL_EVENT
: DeviceCUDA.h
- cuda_check_local_calc()
: ComputeNonbondedCUDA.C
- cuda_check_local_progress()
: ComputeNonbondedCUDA.C
- cuda_check_pme_charges()
: ComputePme.C
- cuda_check_pme_forces()
: ComputePme.C
- cuda_check_progress()
: ComputeNonbondedCUDA.C
- cuda_check_remote_calc()
: ComputeNonbondedCUDA.C
- cuda_check_remote_progress()
: ComputeNonbondedCUDA.C
- CUDA_DEBUG_EVENT
: DeviceCUDA.h
- cuda_device_pe()
: ComputeNonbondedCUDA.h
- cuda_device_shared_with_pe()
: ComputeNonbondedCUDA.h
- cuda_errcheck()
: ComputeNonbondedCUDAKernel.h
, ComputePme.C
, ComputeNonbondedCUDA.C
- CUDA_EVENT_ID_BASE
: DeviceCUDA.h
- CUDA_EVENT_ID_PME_CHARGES
: ComputePme.C
- CUDA_EVENT_ID_PME_COPY
: ComputePme.C
- CUDA_EVENT_ID_PME_FORCES
: ComputePme.C
- CUDA_EVENT_ID_PME_KERNEL
: ComputePme.C
- CUDA_EVENT_ID_PME_TICK
: ComputePme.C
- CUDA_EVENT_ID_POLL_LOCAL
: DeviceCUDA.h
- CUDA_EVENT_ID_POLL_REMOTE
: DeviceCUDA.h
- cuda_finalize()
: BackEnd.C
, DeviceCUDA.C
- CUDA_GBIS1_KERNEL_EVENT
: DeviceCUDA.h
- CUDA_GBIS2_KERNEL_EVENT
: DeviceCUDA.h
- CUDA_GBIS3_KERNEL_EVENT
: DeviceCUDA.h
- cuda_GBIS_P1()
: ComputeNonbondedCUDAKernel.cu
, ComputeNonbondedCUDAKernel.h
- cuda_GBIS_P2()
: ComputeNonbondedCUDAKernel.cu
, ComputeNonbondedCUDAKernel.h
- cuda_GBIS_P3()
: ComputeNonbondedCUDAKernel.cu
, ComputeNonbondedCUDAKernel.h
- cuda_getargs()
: DeviceCUDA.C
, BackEnd.C
- cuda_init()
: ComputeNonbondedCUDAKernel.cu
, ComputeNonbondedCUDAKernel.h
- cuda_init_bspline_coeffs()
: ComputePmeCUDAKernel.h
, ComputePmeCUDAKernel.cu
- cuda_initialize()
: WorkDistrib.C
, DeviceCUDA.C
- cuda_nonbonded_forces()
: ComputeNonbondedCUDAKernel.h
, ComputeNonbondedCUDAKernel.cu
- CUDA_NONBONDED_KERNEL_EVENT
: DeviceCUDA.h
- cuda_pme_charges_batched_dev()
: ComputePmeCUDAKernel.cu
- CUDA_PME_CHARGES_BATCHED_PROTOTYPE
: ComputePmeCUDAKernel.cu
, ComputePmeCUDAKernel.h
- cuda_pme_charges_dev()
: ComputePmeCUDAKernel.cu
- CUDA_PME_CHARGES_PROTOTYPE
: ComputePmeCUDAKernel.h
- cuda_pme_forces_dev()
: ComputePmeCUDAKernel.cu
- CUDA_PME_FORCES_PROTOTYPE
: ComputePmeCUDAKernel.h
, ComputePmeCUDAKernel.cu
, ComputePmeCUDAKernel.h
- CUDA_PME_GATHERFORCE_EVENT
: DeviceCUDA.h
- CUDA_PME_SPREADCHARGE_EVENT
: DeviceCUDA.h
- CUDA_POLL
: ComputePme.C
, ComputeNonbondedCUDA.C
- cuda_static_assert
: CudaUtils.h
- CUDA_STREAM_CREATE
: ComputePme.C
- cuda_stream_finished()
: ComputeNonbondedCUDAKernel.h
- cuda_timer_count
: ComputeNonbondedCUDA.C
- cuda_timer_total
: ComputeNonbondedCUDA.C
- CUDA_TRACE_LOCAL
: DeviceCUDA.h
- CUDA_TRACE_POLL_LOCAL
: DeviceCUDA.h
- CUDA_TRACE_POLL_REMOTE
: DeviceCUDA.h
- CUDA_TRACE_REMOTE
: DeviceCUDA.h
- CudaAtomList
: NamdTypes.h
- cudaCheck
: CudaUtils.h
- cudaCompute
: ComputeNonbondedCUDA.C
- cudaDie()
: CudaUtils.h
, CudaUtils.C
, ComputePme.C
- cudaFuncSetSharedMemConfig
: ComputePmeCUDAKernel.cu
- cudaNAMD_bug()
: CudaUtils.h
, CudaUtils.C
- cudaPatches
: CudaComputeNonbondedKernel.cu
- cufftCheck
: CudaPmeSolverUtil.h
- custom_ComputeQMAtom_Less()
: ComputeQM.C
- cutoff2
: CudaComputeNonbondedKernel.cu
- CWDSIZE
: mainfunc.C
- CYCLE_BARRIER
: common.h