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(-)kemistry-0.7b/openbabel/mol.h (-1 / +1 lines)
Lines 22-28 Link Here
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#include <algorithm>

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#include <algorithm>

        

        

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#include <vector>

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#include <vector>

        

          
            

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#include <string>


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#include <cstring>

            

        

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#include <iostream>

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#include <iostream>

        

        

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#include <fstream>

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#include <fstream>

        

        

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(-)kemistry-0.7b/openbabel/data.h
      (-1 / +1 lines)




  

    
      
            Lines 24-30
          
      
      
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#include <fstream>

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#include <fstream>

        

        

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#include <vector>

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#include <vector>

        

          
            

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#include <string>


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#include <cstring>

            

        

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namespace OpenBabel {

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namespace OpenBabel {

        

        

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(-)kemistry-0.7b/openbabel/cml.cpp
      (-2 lines)




  

    
      
            Lines 514-521
          
      
      
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// symmetry

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// symmetry

        

        

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string spacegroup;

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string spacegroup;

        

        

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string pointgroup;

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string pointgroup;

        

            

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vector <double[12]> rotTransVector;

              
              
            

            

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vector <double[9]> rotVector;

            

        

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// angle

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// angle

        

        

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vector <pair <vector<OBAtom*>, double> > angleVector;

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vector <pair <vector<OBAtom*>, double> > angleVector;

        



(-)kemistry-0.7b/openbabel/data.cpp
      (+2 lines)




  

    
      
            Lines 26-31
          
      
      
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#include "extable.h"

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#include "extable.h"

        

        

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#include <strstream>

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#include <strstream>

        

            

              
              
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#include <cstdlib>

            

            

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#include <cstring>

            

        

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using namespace std;

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using namespace std;

        

        

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