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src/b/i/biskit-2.4/Biskit/Dock/Complex.py   biskit(Download)
        if not 'foldX' in rec.info or rec.xyzChanged or force:
            d = PDBDope( rec )
            d.addFoldX()
 
        if not 'foldX' in lig.info or lig.xyzChanged or force:
            d = PDBDope( lig )
            d.addFoldX()
 
        d = PDBDope( m )
        d.addFoldX()
 
        e_rec = rec.info['foldX']