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root/OpenMD/trunk/src/brains/ForceField.hpp
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Comparing trunk/src/UseTheForce/ForceField.hpp (file contents):
Revision 762 by gezelter, Mon Nov 21 22:59:02 2005 UTC vs.
Revision 963 by tim, Wed May 17 21:51:42 2006 UTC

# Line 61 | Line 61
61   #include "types/BondType.hpp"
62   #include "types/BendType.hpp"
63   #include "types/TorsionType.hpp"
64 <
64 > #include "UseTheForce/fForceOptions.h"
65   namespace oopse {
66  
67    /**
# Line 109 | Line 109 | namespace oopse {
109  
110      //avoid make virtual function public
111      //Herb Sutter and Andrei Alexandrescu, C++ coding Standards, Addision-Wesley
112 <    virtual double getRcutFromAtomType(AtomType* at);
112 >    virtual RealType getRcutFromAtomType(AtomType* at);
113  
114      std::string getWildCard() {
115        return wildCardAtomTypeName_;
# Line 138 | Line 138 | namespace oopse {
138      ifstrstream* openForceFieldFile(const std::string& filename);
139  
140      ForceFieldOptions& getForceFieldOptions() {return forceFieldOptions_;}
141 +
142 +    void setFortranForceOptions(void);
143    protected:
144  
145      AtomTypeContainer atomTypeCont_;    

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