Rosetta 3.4
Public Types | Public Member Functions
core::scoring::methods::UnfoldedStateEnergy Class Reference

#include <UnfoldedStateEnergy.hh>

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List of all members.

Public Types

typedef
ContextIndependentOneBodyEnergy 
parent

Public Member Functions

 UnfoldedStateEnergy (std::string const &type)
 UnfoldedStateEnergy (std::string const &type, const EnergyMap &emap_in)
 ~UnfoldedStateEnergy ()
virtual EnergyMethodOP clone () const
virtual void residue_energy (conformation::Residue const &rsd, pose::Pose const &pose, EnergyMap &emap) const
 Evaluate the one-body energies for a particular residue, in the context of a given Pose, and increment those energies in the input Emap (do not overwrite them).
virtual void indicate_required_context_graphs (utility::vector1< bool > &) const
 Indicate in the context-graphs-required list which context-graphs this energy method requires that the Pose maintain when doing neighbor evaluation. Context graphs are allowed.

Member Typedef Documentation


Constructor & Destructor Documentation

core::scoring::methods::UnfoldedStateEnergy::UnfoldedStateEnergy ( std::string const &  type)
core::scoring::methods::UnfoldedStateEnergy::UnfoldedStateEnergy ( std::string const &  type,
const EnergyMap emap_in 
)
core::scoring::methods::UnfoldedStateEnergy::~UnfoldedStateEnergy ( )

Member Function Documentation

EnergyMethodOP core::scoring::methods::UnfoldedStateEnergy::clone ( ) const [virtual]
void core::scoring::methods::UnfoldedStateEnergy::indicate_required_context_graphs ( utility::vector1< bool > &  context_graphs_required) const [virtual]

Indicate in the context-graphs-required list which context-graphs this energy method requires that the Pose maintain when doing neighbor evaluation. Context graphs are allowed.

Implements core::scoring::methods::EnergyMethod.

void core::scoring::methods::UnfoldedStateEnergy::residue_energy ( conformation::Residue const &  rsd,
pose::Pose const &  pose,
EnergyMap emap 
) const [virtual]

Evaluate the one-body energies for a particular residue, in the context of a given Pose, and increment those energies in the input Emap (do not overwrite them).

Implements core::scoring::methods::ContextIndependentOneBodyEnergy.

References core::scoring::EMapVector::dot(), core::chemical::ResidueType::name3(), core::scoring::UnfoldedStatePotential::raw_unfolded_state_energymap(), core::conformation::Residue::type(), and core::scoring::unfolded.


The documentation for this class was generated from the following files:
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