Main Page | Namespace List | Class Hierarchy | Alphabetical List | Class List | File List | Class Members | File Members

PatchTypes.h

Go to the documentation of this file.
00001 
00007 #ifndef PATCHTYPES_H
00008 #define PATCHTYPES_H
00009 
00010 #include "NamdTypes.h"
00011 #include "Lattice.h"
00012 
00013 class Flags
00014 {
00015 public:
00016   int step;                     // timestep number reported to user
00017                                 // Same number may appear multiple times!
00018   int sequence;                 // sequence number of compute call
00019                                 // changes by 1 every time!
00020   int doEnergy;
00021   int doNonbonded;
00022   int doFullElectrostatics;
00023   int doMolly;
00024   int submitLoadStats;
00025   int maxForceUsed;             // may ignore slower force classes
00026   int maxForceMerged;           // add this and faster to normal
00027 
00028   int usePairlists;
00029   int savePairlists;
00030   BigReal pairlistTolerance;
00031   BigReal maxAtomMovement;
00032   BigReal maxGroupRadius;
00033 
00034   Lattice lattice;              // rather than shipping around separately
00035 
00036   inline Flags& operator= (const Flags &flags) 
00037     {
00038       CmiMemcpy (this, &flags, sizeof(Flags));
00039       return *this;
00040     }
00041 
00042 };
00043 
00044 class Results
00045 {
00046 public:
00047   enum { normal=0, nbond=1, slow=2, maxNumForces=3 };
00048   Force *f[maxNumForces];
00049 };
00050 
00051 #endif
00052 

Generated on Sun Sep 7 04:07:41 2008 for NAMD by  doxygen 1.3.9.1