#include <HydrophobicInteractionScore.hpp>

Inheritance diagram for CDPL::Pharm::HydrophobicInteractionScore:

Public Types
typedef std::shared_ptr< HydrophobicInteractionScore >	SharedPointer
	A reference-counted smart pointer [SHPTR] for dynamically allocated `HydrophobicInteractionScore` instances. More...

Public Types inherited from CDPL::Pharm::FeatureDistanceScore
typedef std::shared_ptr< FeatureDistanceScore >	SharedPointer
	A reference-counted smart pointer [SHPTR] for dynamically allocated `FeatureDistanceScore` instances. More...

typedef std::function< double(double)>	DistanceScoringFunction

Public Types inherited from CDPL::Pharm::FeatureInteractionScore
typedef std::shared_ptr< FeatureInteractionScore >	SharedPointer
	A reference-counted smart pointer [SHPTR] for dynamically allocated `FeatureInteractionScore` instances. More...

Public Member Functions
	HydrophobicInteractionScore (double min_dist=DEF_MIN_DISTANCE, double max_dist=DEF_MAX_DISTANCE)
	Constructs a `HydrophobicInteractionScore` functor with a minimum hydrophobic-feature pair distance of min_dist and a maximum distance of max_dist. More...

Public Member Functions inherited from CDPL::Pharm::FeatureDistanceScore
	FeatureDistanceScore (double min_dist, double max_dist)
	Constructs a `FeatureDistanceScore` functor with a minimum feature distance of min_dist and maximum distance of max_dist. More...

double	getMinDistance () const

double	getMaxDistance () const

void	setDistanceScoringFunction (const DistanceScoringFunction &func)

double	operator() (const Feature &ftr1, const Feature &ftr2) const

double	operator() (const Math::Vector3D &ftr1_pos, const Feature &ftr2) const

Public Member Functions inherited from CDPL::Pharm::FeatureInteractionScore
virtual	~FeatureInteractionScore ()
	Virtual destructor. More...

Static Public Attributes
static constexpr double	DEF_MIN_DISTANCE = 2.0

static constexpr double	DEF_MAX_DISTANCE = 6.0

Additional Inherited Members
Protected Member Functions inherited from CDPL::Pharm::FeatureInteractionScore
	FeatureInteractionScore ()

Detailed Description

HydrophobicInteractionScore.

Member Typedef Documentation

◆ SharedPointer

typedef std::shared_ptr<HydrophobicInteractionScore> CDPL::Pharm::HydrophobicInteractionScore::SharedPointer

A reference-counted smart pointer [SHPTR] for dynamically allocated HydrophobicInteractionScore instances.

Constructor & Destructor Documentation

◆ HydrophobicInteractionScore()

CDPL::Pharm::HydrophobicInteractionScore::HydrophobicInteractionScore	(	double	min_dist = `DEF_MIN_DISTANCE`,
		double	max_dist = `DEF_MAX_DISTANCE`
	)

inline

Constructs a HydrophobicInteractionScore functor with a minimum hydrophobic-feature pair distance of min_dist and a maximum distance of max_dist.

Parameters

min_dist	The minimum allowed feature pair distance.
max_dist	The maximum allowed feature pair distance.

Member Data Documentation

◆ DEF_MIN_DISTANCE

constexpr double CDPL::Pharm::HydrophobicInteractionScore::DEF_MIN_DISTANCE = 2.0

staticconstexpr

◆ DEF_MAX_DISTANCE

constexpr double CDPL::Pharm::HydrophobicInteractionScore::DEF_MAX_DISTANCE = 6.0

staticconstexpr

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

HydrophobicInteractionScore.hpp

Public Types

Public Member Functions

Static Public Attributes

Additional Inherited Members