protocols::enzdes::DesignVsNativeComparison Class Reference

class that holds a bunch of native poses and compares them More...

#include <DesignVsNativeComparison.hh>

Public Member Functions
	DesignVsNativeComparison ()
virtual	~DesignVsNativeComparison ()
void	compare_to_native (core::pose::Pose const &pose, utility::vector1< std::pair< std::string, std::string > > const &calculators, core::scoring::ScoreFunctionCOP scorefxn, utility::vector1< core::io::silent::SilentEnergy > &silent_Es)

Private Attributes
std::map< std::string, core::pose::PoseOP >	native_poses_

Detailed Description

class that holds a bunch of native poses and compares them

against a given input pose on request

Constructor & Destructor Documentation

protocols::enzdes::DesignVsNativeComparison::DesignVsNativeComparison

(

)

References native_poses_.

protocols::enzdes::DesignVsNativeComparison::~DesignVsNativeComparison ( )

virtual

Member Function Documentation

void protocols::enzdes::DesignVsNativeComparison::compare_to_native	(	core::pose::Pose const &	pose,
		utility::vector1< std::pair< std::string, std::string > > const &	calculators,
		core::scoring::ScoreFunctionCOP	scorefxn,
		utility::vector1< core::io::silent::SilentEnergy > &	silent_Es
	)

References basic::options::OptionKeys::enzdes::compare_native, core::pose::Pose::constraint_set(), core::scoring::EMapVector::dot(), core::pose::Pose::energies(), protocols::enzdes::enzutil::get_pdb_code_from_pose_tag(), core::pose::Pose::metric(), native, native_poses_, basic::options::option, core::import_pose::pose_from_pdb(), protocols::toolbox::pose_manipulation::remove_non_protein_residues(), core::scoring::Energies::total_energies(), basic::MetricValue< T >::value(), and core::scoring::Energies::weights().

Member Data Documentation

std::map< std::string, core::pose::PoseOP > protocols::enzdes::DesignVsNativeComparison::native_poses_

private

Referenced by compare_to_native(), and DesignVsNativeComparison().

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

• symlinks/rosetta/src/protocols/enzdes/DesignVsNativeComparison.hh
• symlinks/rosetta/src/protocols/enzdes/DesignVsNativeComparison.cc