ShapeSimilarityCalculator.hh File Reference

Headers for the ShapeSimilarityCalculator. More...

#include <core/types.hh>
#include <core/pose/Pose.fwd.hh>
#include <core/conformation/Residue.fwd.hh>
#include <core/scoring/sc/ShapeSimilarityCalculator.fwd.hh>
#include <core/scoring/sc/MolecularSurfaceCalculator.hh>
#include <numeric/xyzVector.hh>
#include <core/select/residue_selector/ResidueIndexSelector.hh>
#include <core/select/residue_selector/util.hh>
#include <core/select/residue_selector/ResidueVector.hh>
#include <vector>
#include <string>
#include <utility/vector1.hh>

Classes
class	core::scoring::sc::ShapeSimilarityCalculator

Namespaces
	core
	A class for reading in the atom type properties.
	core::scoring
	core::scoring::sc

Detailed Description

Headers for the ShapeSimilarityCalculator.

The code modifies Luki Goldschmidt's implementation of Lawrence & Coleman shape complementarity calculator to allow for the comparison of similar surface shapes.

Author

Andreas Scheck (andre.nosp@m.as.s.nosp@m.check.nosp@m.@epf.nosp@m.l.ch)