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Timestep.h File Reference

#include "ResizeArray.h"
#include "Matrix4.h"
#include "QMTimestep.h"

Go to the source code of this file.

Compounds

class  Timestep
 Timesteps store coordinates, energies, etc. for one trajectory timestep. More...


Enumerations

enum  {
  TSE_BOND, TSE_ANGLE, TSE_DIHE, TSE_IMPR,
  TSE_VDW, TSE_COUL, TSE_HBOND, TSE_KE,
  TSE_PE, TSE_TEMP, TSE_TOTAL, TSE_VOLUME,
  TSE_PRESSURE, TSE_EFIELD, TSE_UREY_BRADLEY, TSE_RESTRAINT,
  TSENERGIES
}


Enumeration Type Documentation

anonymous enum
 

Enumeration values:
TSE_BOND 
TSE_ANGLE 
TSE_DIHE 
TSE_IMPR 
TSE_VDW 
TSE_COUL 
TSE_HBOND 
TSE_KE 
TSE_PE 
TSE_TEMP 
TSE_TOTAL 
TSE_VOLUME 
TSE_PRESSURE 
TSE_EFIELD 
TSE_UREY_BRADLEY 
TSE_RESTRAINT 
TSENERGIES 

Definition at line 37 of file Timestep.h.


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