GeometryDihedral.h

00001 /***************************************************************************
00002 *cr 
00003 *cr (C) Copyright 1995-2019 The Board of Trustees of the 
00004 *cr University of Illinois 
00005 *cr All Rights Reserved 
00006 *cr 
00007 ***************************************************************************/
00008 
00009 /***************************************************************************
00010 * RCS INFORMATION:
00011 *
00012 * $RCSfile: GeometryDihedral.h,v $
00013 * $Author: johns $ $Locker: $ $State: Exp $
00014 * $Revision: 1.25 $ $Date: 2019年01月17日 21:20:59 $
00015 *
00016 ***************************************************************************
00017 * DESCRIPTION:
00018 *
00019 * Measures the angle between four atoms, and draws a marker for the dihedral
00020 * into the display list for a given Displayable.
00021 *
00022 ***************************************************************************/
00023 #ifndef GEOMETRYDIHE_H
00024 #define GEOMETRYDIHE_H
00025 
00026 #include "GeometryMol.h"
00027 
00029 class GeometryDihedral : public GeometryMol {
00030 
00031 public:
00033 GeometryDihedral(int *, int *, const int *cell, MoleculeList *, CommandQueue *, Displayable *);
00034 
00035 // public virtual routines
00036 virtual float calculate(void); 
00037 virtual void create_cmd_list(); 
00038 virtual void set_pick(void); 
00039 };
00040 
00041 #endif
00042