Rosetta  2020.37
 All Classes Namespaces Files Functions Variables Typedefs Enumerations Enumerator Friends Macros Pages
Public Member Functions | Protected Member Functions | Private Attributes | List of all members
protocols::pose_metric_calculators::PiPiCalculator Class Reference

#include <PiPiCalculator.hh>

Inheritance diagram for protocols::pose_metric_calculators::PiPiCalculator:
Inheritance graph
[legend]

Public Member Functions

 PiPiCalculator ()
 default constructor sets distance_cutoff to 5.0. This is what is usually defined as a Hbond between heavy atom (carbon) and Hydrogen More...
 
 PiPiCalculator (core::Real dist_cutoff)
 constructur where you define what the distance cutoff is for the pi pi More...
 
core::pose::metrics::PoseMetricCalculatorOP clone () const override
 
- Public Member Functions inherited from core::pose::metrics::StructureDependentCalculator
 StructureDependentCalculator ()
 
void notify_structure_change () override
 
void get (std::string const &key, basic::MetricValueBase &val, Pose const &this_pose) override
 
std::string get (std::string const &key, Pose const &this_pose) override
 
- Public Member Functions inherited from core::pose::metrics::PoseMetricCalculator
 PoseMetricCalculator ()
 
virtual void notify_energy_change ()
 

Protected Member Functions

void lookup (std::string const &key, basic::MetricValueBase *valptr) const override
 
std::string print (std::string const &key) const override
 
void recompute (core::pose::Pose const &this_pose) override
 not sure why they name this function recompute as you are actually computing the metric. Whateva More...
 

Private Attributes

core::Real distance_cutoff_
 
core::Size pi_pi_total_
 

Constructor & Destructor Documentation

protocols::pose_metric_calculators::PiPiCalculator::PiPiCalculator ( )

default constructor sets distance_cutoff to 5.0. This is what is usually defined as a Hbond between heavy atom (carbon) and Hydrogen

protocols::pose_metric_calculators::PiPiCalculator::PiPiCalculator ( core::Real  dist_cutoff)

constructur where you define what the distance cutoff is for the pi pi

Member Function Documentation

core::pose::metrics::PoseMetricCalculatorOP protocols::pose_metric_calculators::PiPiCalculator::clone ( ) const
inlineoverridevirtual
void protocols::pose_metric_calculators::PiPiCalculator::lookup ( std::string const &  key,
basic::MetricValueBase *  valptr 
) const
overrideprotectedvirtual
std::string protocols::pose_metric_calculators::PiPiCalculator::print ( std::string const &  key) const
overrideprotectedvirtual
void protocols::pose_metric_calculators::PiPiCalculator::recompute ( core::pose::Pose const &  this_pose)
overrideprotectedvirtual

not sure why they name this function recompute as you are actually computing the metric. Whateva

Implements core::pose::metrics::StructureDependentCalculator.

References core::kinematics::distance(), distance_cutoff_, pi_pi_total_, core::pose::Pose::residue(), and core::pose::Pose::size().

Member Data Documentation

core::Real protocols::pose_metric_calculators::PiPiCalculator::distance_cutoff_
private

Referenced by recompute().

core::Size protocols::pose_metric_calculators::PiPiCalculator::pi_pi_total_
private

Referenced by lookup(), print(), and recompute().


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