PmePencilX Class Reference

#include <PmeSolver.h>

Inheritance diagram for PmePencilX:

Public Member Functions
PmePencilX_SDAG_CODE	PmePencilX ()
	PmePencilX (CkMigrateMessage *m)
virtual	~PmePencilX ()

Protected Member Functions
void	initBlockSizes ()

Protected Attributes
PmeGrid	pmeGrid
bool	doEnergy
bool	doVirial
FFTCompute *	fftCompute
PmeTranspose *	pmeTranspose
std::vector< int >	blockSizes
Lattice	lattice
int	numStrayAtoms
int	imsg

Detailed Description

Definition at line 184 of file PmeSolver.h.

Constructor & Destructor Documentation

PmePencilX::PmePencilX

(

)

Definition at line 224 of file PmeSolver.C.

References fftCompute, numStrayAtoms, and pmeTranspose.

                       {
  __sdag_init();
  setMigratable(false);
  fftCompute = NULL;
  pmeTranspose = NULL;
  numStrayAtoms = 0;
}

PmePencilX::PmePencilX

(

CkMigrateMessage *

m

)

Definition at line 232 of file PmeSolver.C.

References NAMD_bug().

                                          {
  NAMD_bug("PmePencilX cannot be migrated");
//__sdag_init();
  // setMigratable(false);
  // fftCompute = NULL;
  // pmeTranspose = NULL;
}

PmePencilX::~PmePencilX ( )

virtual

Definition at line 240 of file PmeSolver.C.

References fftCompute, and pmeTranspose.

                        {
  if (fftCompute != NULL) delete fftCompute;
  if (pmeTranspose != NULL) delete pmeTranspose;
}

Member Function Documentation

void PmePencilX::initBlockSizes ( )

protected

Definition at line 263 of file PmeSolver.C.

References blockSizes, getBlockDim(), Perm_cX_Y_Z, pmeGrid, x, and PmeGrid::xBlocks.

                                {
  blockSizes.resize(pmeGrid.xBlocks);
  for (int x=0;x < pmeGrid.xBlocks;x++) {
    int i0, i1, j0, j1, k0, k1;
    getBlockDim(pmeGrid, Perm_cX_Y_Z, x, thisIndex.y, thisIndex.z,
      i0, i1, j0, j1, k0, k1);
    int size = (i1-i0+1)*(j1-j0+1)*(k1-k0+1);
    blockSizes[x] = size;
  }
}

Member Data Documentation

std::vector<int> PmePencilX::blockSizes

protected

Definition at line 195 of file PmeSolver.h.

Referenced by initBlockSizes().

bool PmePencilX::doEnergy

protected

Definition at line 192 of file PmeSolver.h.

bool PmePencilX::doVirial

protected

Definition at line 192 of file PmeSolver.h.

FFTCompute* PmePencilX::fftCompute

protected

Definition at line 193 of file PmeSolver.h.

Referenced by PmePencilX(), and ~PmePencilX().

int PmePencilX::imsg

protected

Definition at line 199 of file PmeSolver.h.

Lattice PmePencilX::lattice

protected

Definition at line 196 of file PmeSolver.h.

int PmePencilX::numStrayAtoms

protected

Definition at line 197 of file PmeSolver.h.

Referenced by PmePencilX().

PmeGrid PmePencilX::pmeGrid

protected

Definition at line 191 of file PmeSolver.h.

Referenced by initBlockSizes().

PmeTranspose* PmePencilX::pmeTranspose

protected

Definition at line 194 of file PmeSolver.h.

Referenced by PmePencilX(), and ~PmePencilX().

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The documentation for this class was generated from the following files:

• PmeSolver.h
• PmeSolver.C