CDPL::Pharm::IonicInteractionConstraint Class Reference

IonicInteractionConstraint. More...

#include <IonicInteractionConstraint.hpp>

Inheritance diagram for CDPL::Pharm::IonicInteractionConstraint:

Public Member Functions
	IonicInteractionConstraint (double min_dist=DEF_MIN_DISTANCE, double max_dist=DEF_MAX_DISTANCE)
	Constructs a IonicInteractionConstraint functor with a minimum ionic-feature pair distance of min_dist and a maximum distance of max_dist. More...
Public Member Functions inherited from CDPL::Pharm::FeatureDistanceConstraint
	FeatureDistanceConstraint (double min_dist, double max_dist)
	Constructs a FeatureDistanceConstraint functor with a minimum feature distance of min_dist and maximum distance of max_dist. More...
double	getMinDistance () const
double	getMaxDistance () const
bool	operator() (const Feature &ftr1, const Feature &ftr2) const

Static Public Attributes
static constexpr double	DEF_MIN_DISTANCE = 1.5
static constexpr double	DEF_MAX_DISTANCE = 5.5

Detailed Description

IonicInteractionConstraint.

Constructor & Destructor Documentation

IonicInteractionConstraint()

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

inline

Constructs a IonicInteractionConstraint functor with a minimum ionic-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::IonicInteractionConstraint::DEF_MIN_DISTANCE = 1.5

staticconstexpr

DEF_MAX_DISTANCE

constexpr double CDPL::Pharm::IonicInteractionConstraint::DEF_MAX_DISTANCE = 5.5

staticconstexpr

---

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

• IonicInteractionConstraint.hpp