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Sourcecode: pymol version File versions  Download package


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_Symmetry
#define _H_Symmetry


typedef struct { 
  PyMOLGlobals *G;
  CCrystal *Crystal;
  WordType PDBSpaceGroup;
  int PDBZValue;
  WordType SpaceGroup;
  ov_size NSymMat;
  float *SymMatVLA;
  ov_size NSymOp;
  WordType *SymOpVLA;

} CSymmetry;

int SymmetryAttemptGeneration(CSymmetry *I,int quiet);
void SymmetryFree(CSymmetry *I);
CSymmetry *SymmetryNew(PyMOLGlobals *G);
void SymmetryUpdate(CSymmetry *I);
void SymmetryDump(CSymmetry *I);
CSymmetry *SymmetryCopy(CSymmetry *other);
PyObject *SymmetryAsPyList(CSymmetry *I);
int SymmetryFromPyList(CSymmetry *I,PyObject *list);
CSymmetry *SymmetryNewFromPyList(PyMOLGlobals *G,PyObject *list);
void SymmetryReset(CSymmetry *I);


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