Пример #1
0
void SetupJob ()
{
    AllocArrays ();
    stepCount = 0;
    InitCoords ();
    InitVels ();
    InitAccels ();
    AccumProps (0);
}
Пример #2
0
void SetupJob ()
{
  AllocArrays ();
  InitCoords ();
  InitVels ();
  timeNow = nextSumTime = 0.;
  collCount = crossCount = 0.;
  StartRun ();
  ScheduleEvent (0, MOL_LIMIT + 6, nextSumTime);
  InitFreePath ();
}
Пример #3
0
void SetupJob ()
{
  AllocArrays ();
  DefineMol ();
  stepCount = 0;
  InitCoords ();
  InitVels ();
  InitAccels ();
  InitAngCoords ();
  InitAngVels ();
  InitAngAccels ();
  AccumProps (0);
}
Пример #4
0
void SetupJob ()
{
  AllocArrays ();
  InitRand (randSeed);
  stepCount = 0;
  InitCoords ();
  InitVels ();
  InitAccels ();
  InitAngCoords ();
  InitAngVels ();
  InitAngAccels ();
  AccumProps (0);
  countRdf = 0;
}
Пример #5
0
void SetupJob ()
{
  SetupFiles ();
  AllocArrays ();
  InitCoords ();
  InitVels ();
  timeNow = nextSumTime = 0.;
  collCount = crossCount = 0.;
  countGrid = 0;
  nextSnapTime = intervalGrid;
  StartRun ();
  GridAverage (0);
  ScheduleEvent (0, MOL_LIMIT + 6, nextSumTime);
  ScheduleEvent (0, MOL_LIMIT + 7, nextSnapTime);
}