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root/group/trunk/OOPSE/utils/sysbuilder/MoLocator.hpp
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Comparing trunk/OOPSE/utils/sysbuilder/MoLocator.hpp (file contents):
Revision 678 by chuckv, Mon Aug 11 22:12:31 2003 UTC vs.
Revision 825 by mmeineke, Mon Oct 27 22:08:36 2003 UTC

# Line 5 | Line 5
5   #include "MoleculeStamp.hpp"
6   #include "SimState.hpp"
7  
8 –
8   class MoLocator{
9    
10   public:
# Line 14 | Line 13 | class MoLocator{ (public)
13    ~MoLocator();
14  
15    void placeMol( double pos[3], double ornt[3][3], Atom** atomArray,
16 <                 int atomIndex );
16 >                 int atomIndex, SimState* myConfig );
17    double getMaxLength( void ) { return maxLength; }
18  
20 – void setConfig( SimState* theConfig );
21 –
19   private:
20    
21    void calcRefCoords( void );
# Line 29 | Line 26 | void setConfig( SimState* theConfig ); (private)
26    double maxLength;
27    int nAtoms;
28  
32 –  SimState* myConfig;
33 –  bool haveConfig;
29   };
30  
31 + extern void getRandomRot( double rot[3][3] );
32 + extern void getEulerRot( double theta, double phi, double psi,
33 +                         double rot[3][3] );
34  
35   #endif

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