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root/group/branches/new_design/OOPSE-4/src/types/BondType.hpp
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Comparing branches/new_design/OOPSE-4/src/types/BondType.hpp (file contents):
Revision 1742 by tim, Tue Nov 16 20:36:18 2004 UTC vs.
Revision 1743 by gezelter, Tue Nov 16 22:04:26 2004 UTC

# Line 34 | Line 34 | namespace oopse {
34   #define TYPES_BONDTYPE_HPP
35  
36   namespace oopse {
37 +  
38 +  /**
39 +   * @class BondType BondType.hpp "types/BondType.hpp"
40 +   * @todo using shared_ptr instead of pointer
41 +   */
42 +  class BondType {
43 +  public:
44 +    BondType();
45 +    virtual ~BondType() {}
46 +    
47 +    virtual void calcForce(double r, double& V, double& dVdr) = 0;
48 +    
49 +  protected:        
50 +  };    
51  
38 – /**
39 – * @class BondType BondType.hpp "types/BondType.hpp"
40 – * @todo using shared_ptr instead of pointer
41 – */
42 – class BondType {
43 –    public:
44 –        BondType(AtomType* at1, AtomType* at2);
45 –        virtual ~BondType() {}
52  
47 –        virtual void calcForce(double len, double& force, double& potential) = 0;
48 –
49 –    protected:
50 –        AtomType* at1_;
51 –        AtomType* at2_;
52 –        
53 – };    
54 –
55 –
53   } //end namespace oopse
54   #endif //TYPES_BONDTYPE_HPP    

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