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root/group/trunk/OOPSE/libmdtools/DirectionalAtom.hpp
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Comparing trunk/OOPSE/libmdtools/DirectionalAtom.hpp (file contents):
Revision 1097 by gezelter, Mon Apr 12 20:32:20 2004 UTC vs.
Revision 1187 by chrisfen, Sat May 22 18:16:18 2004 UTC

# Line 54 | Line 54 | class DirectionalAtom : public Atom { (public)
54    void lab2Body( double r[3] );
55    void body2Lab( double r[3] );
56  
57 +  double getZangle( );
58 +  void setZangle( double zAng );
59 +  void addZangle( double zAng );
60 +
61    // Four functions added for derivatives with respect to Euler Angles:
62    // (Needed for minimization routines):
63  
# Line 62 | Line 66 | class DirectionalAtom : public Atom { (public)
66  
67    double max(double x, double y);
68    double min(double x, double y);
69 +
70 +  virtual void accept(BaseVisitor* v) {v->visit(this);}
71    
72   private:
73    int dIndex;

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