PatchTypes.h

Go to the documentation of this file.

#ifndef PATCHTYPES_H
#define PATCHTYPES_H

#include "NamdTypes.h"
#include "Lattice.h"

class Flags
{
public:
  int step;                     // timestep number reported to user
                                // Same number may appear multiple times!
  int sequence;                 // sequence number of compute call
                                // changes by 1 every time!
  int doEnergy;
  int doNonbonded;
  int doFullElectrostatics;
  int doMolly;
  int submitLoadStats;
  int maxForceUsed;             // may ignore slower force classes
  int maxForceMerged;           // add this and faster to normal

  int usePairlists;
  int savePairlists;
  BigReal pairlistTolerance;
  BigReal maxAtomMovement;
  BigReal maxGroupRadius;

  Lattice lattice;              // rather than shipping around separately

  inline Flags& operator= (const Flags &flags) 
    {
      CmiMemcpy (this, &flags, sizeof(Flags));
      return *this;
    }

};

class Results
{
public:
  enum { normal=0, nbond=1, slow=2, maxNumForces=3 };
  Force *f[maxNumForces];
};

#endif

---