HBNetEnergy.fwd.hh File Reference

Forward declarations for an EnergyMethod that gives a bonus for hydrogen bond networks, which ramps nonlinearly with the size of the networks. More...

#include <utility/pointer/owning_ptr.hh>

Namespaces
	core
	A class for reading in the atom type properties.
	core::pack
	core::pack::guidance_scoreterms
	core::pack::guidance_scoreterms::hbnet_energy

Typedefs
typedef utility::pointer::shared_ptr < HBNetEnergy >	core::pack::guidance_scoreterms::hbnet_energy::HBNetEnergyOP
typedef utility::pointer::shared_ptr < HBNetEnergy const >	core::pack::guidance_scoreterms::hbnet_energy::HBNetEnergyCOP

Detailed Description

Forward declarations for an EnergyMethod that gives a bonus for hydrogen bond networks, which ramps nonlinearly with the size of the networks.

This energy method is inherently not pairwise decomposible. However, it is intended for very rapid calculation, and has been designed to plug into Alex Ford's modifications to the packer that permit it to work with non-pairwise scoring terms. It has also been modified to permit sub-regions of a pose to be scored.

Author

Vikram K. Mulligan (vmull.nosp@m.ig@u.nosp@m.w.edu).