ElectrostaticSimilarityMetric.hh File Reference

Header file for ElectrostaticSimilarityMetric class. More...

#include <core/simple_metrics/composite_metrics/ElectrostaticSimilarityMetric.fwd.hh>
#include <core/simple_metrics/CompositeRealMetric.hh>
#include <core/scoring/sc/ElectrostaticSimilarityCalculator.fwd.hh>
#include <core/select/residue_selector/ResidueSelector.fwd.hh>
#include <utility/vector1.hh>

Classes
class	core::simple_metrics::composite_metrics::ElectrostaticSimilarityMetric

Namespaces
	core
	A class for reading in the atom type properties.
	core::simple_metrics
	core::simple_metrics::composite_metrics

Detailed Description

Header file for ElectrostaticSimilarityMetric class.

The code closely follows Brian Coventry's implementation of electrostatic complementarity with a added features that in turn is based on the method: McCoy, A. J., Epa, V. C., & Colman, P. M. (1997). Electrostatic complementarity at protein/protein interfaces. Journal of molecular biology, 268(2), 570-584.

Author

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