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Sourcecode: pymol version File versions


A* -------------------------------------------------------------------
B* This file contains source code for the PyMOL computer program
C* copyright 1998-2000 by Warren Lyford Delano of DeLano Scientific. 
D* -------------------------------------------------------------------
E* It is unlawful to modify or remove this copyright notice.
F* -------------------------------------------------------------------
G* Please see the accompanying LICENSE file for further information. 
H* -------------------------------------------------------------------
I* Additional authors of this source file include:
Z* -------------------------------------------------------------------
#ifndef _H_Crystal
#define _H_Crystal


typedef struct { 
  PyMOLGlobals *G;
  float Dim[3];
  float Angle[3]; /* stored in degrees for convenience */
  float RealToFrac[9];
  float FracToReal[9];
  float UnitCellVolume;
  float Norm[3];
  float RecipDim[3];
} CCrystal;

void CrystalFree(CCrystal *I);
void CrystalInit(PyMOLGlobals *G,CCrystal *I);
CCrystal *CrystalNew(PyMOLGlobals *G);
CCrystal *CrystalCopy(CCrystal *I);
void CrystalUpdate(CCrystal *I);
void CrystalDump(CCrystal *I);
CGO *CrystalGetUnitCellCGO(CCrystal *I);
CCrystal *CrystalNewFromPyList(PyMOLGlobals *G,PyObject *list);
int CrystalFromPyList(CCrystal *I,PyObject *list);
PyObject *CrystalAsPyList(CCrystal *I);


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