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root/group/trunk/OOPSE/libmdtools/Atom.hpp
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Comparing trunk/OOPSE/libmdtools/Atom.hpp (file contents):
Revision 1097 by gezelter, Mon Apr 12 20:32:20 2004 UTC vs.
Revision 1118 by tim, Mon Apr 19 03:52:27 2004 UTC

# Line 7 | Line 7
7  
8   #include "SimState.hpp"
9   #include "StuntDouble.hpp"
10 + #include "BaseVisitor.hpp"
11  
12   class Atom : public StuntDouble {
13   public:
# Line 47 | Line 48 | class Atom : public StuntDouble { (public)
48    void setHasDipole( int value ) { has_dipole = value; }
49    int hasDipole( void ) { return has_dipole; }
50  
51 +  void setHasCharge(int value) {has_charge = value;}
52 +  int hasCharge(void) {return has_charge;}
53 +
54 +
55 +  virtual void accept(BaseVisitor* v);
56 +  
57   protected:
58    
59    SimState* myConfig;
# Line 73 | Line 80 | class Atom : public StuntDouble { (public)
80    int ident;  // it's unique numeric identity.
81    
82    int has_dipole; // dipole boolean
83 +  int has_charge; // charge boolean
84  
85    bool hasCoords;
86  

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