CDPL.Pharm.FeatureProperty Class Reference

Provides keys for built-in Pharm.Feature properties. More...

Inheritance diagram for CDPL.Pharm.FeatureProperty:

Static Public Attributes
	TYPE = CDPL.Base.LookupKey('TYPE')
	Specifies the type of the pharmacophore feature (see namespace Pharm.FeatureType). More...
	GEOMETRY = CDPL.Base.LookupKey('GEOMETRY')
	Specifies the geometric shape of the feature (see namespace Pharm.FeatureGeometry). More...
	LENGTH = CDPL.Base.LookupKey('LENGTH')
	Specifies the length of the feature (for directional features). More...
	ORIENTATION = CDPL.Base.LookupKey('ORIENTATION')
	Specifies the orientation of the feature in 3D space. More...
	TOLERANCE = CDPL.Base.LookupKey('TOLERANCE')
	Specifies the positional tolerance of the feature. More...
	WEIGHT = CDPL.Base.LookupKey('WEIGHT')
	Specifies the weight (relative importance) of the feature. More...
	SUBSTRUCTURE = CDPL.Base.LookupKey('SUBSTRUCTURE')
	Specifies the chemical substructure the feature was derived from. More...
	DISABLED_FLAG = CDPL.Base.LookupKey('DISABLED_FLAG')
	Specifies whether the feature is currently disabled (and thus not considered in pharmacophore matching). More...
	OPTIONAL_FLAG = CDPL.Base.LookupKey('OPTIONAL_FLAG')
	Specifies whether the feature is optional in pharmacophore matching. More...
	HYDROPHOBICITY = CDPL.Base.LookupKey('HYDROPHOBICITY')
	Specifies the calculated hydrophobicity contribution of the feature. More...
	ENVIRONMENT_SUBSTRUCTURE = CDPL.Base.LookupKey('ENVIRONMENT_SUBSTRUCTURE')
	Specifies the environment substructure (e.g. More...

Detailed Description

Provides keys for built-in Pharm.Feature properties.

Member Data Documentation

TYPE

CDPL.Pharm.FeatureProperty.TYPE = CDPL.Base.LookupKey('TYPE')

static

Specifies the type of the pharmacophore feature (see namespace Pharm.FeatureType).

Value Type: unsigned int

GEOMETRY

CDPL.Pharm.FeatureProperty.GEOMETRY = CDPL.Base.LookupKey('GEOMETRY')

static

Specifies the geometric shape of the feature (see namespace Pharm.FeatureGeometry).

Value Type: unsigned int

LENGTH

CDPL.Pharm.FeatureProperty.LENGTH = CDPL.Base.LookupKey('LENGTH')

static

Specifies the length of the feature (for directional features).

Value Type: double

ORIENTATION

CDPL.Pharm.FeatureProperty.ORIENTATION = CDPL.Base.LookupKey('ORIENTATION')

static

Specifies the orientation of the feature in 3D space.

Value Type: Math.Vector3D

TOLERANCE

CDPL.Pharm.FeatureProperty.TOLERANCE = CDPL.Base.LookupKey('TOLERANCE')

static

Specifies the positional tolerance of the feature.

Value Type: double

WEIGHT

CDPL.Pharm.FeatureProperty.WEIGHT = CDPL.Base.LookupKey('WEIGHT')

static

Specifies the weight (relative importance) of the feature.

Value Type: double

SUBSTRUCTURE

CDPL.Pharm.FeatureProperty.SUBSTRUCTURE = CDPL.Base.LookupKey('SUBSTRUCTURE')

static

Specifies the chemical substructure the feature was derived from.

Value Type: Chem.Fragment.SharedPointer

DISABLED_FLAG

CDPL.Pharm.FeatureProperty.DISABLED_FLAG = CDPL.Base.LookupKey('DISABLED_FLAG')

static

Specifies whether the feature is currently disabled (and thus not considered in pharmacophore matching).

Value Type: bool

OPTIONAL_FLAG

CDPL.Pharm.FeatureProperty.OPTIONAL_FLAG = CDPL.Base.LookupKey('OPTIONAL_FLAG')

static

Specifies whether the feature is optional in pharmacophore matching.

Value Type: bool

HYDROPHOBICITY

CDPL.Pharm.FeatureProperty.HYDROPHOBICITY = CDPL.Base.LookupKey('HYDROPHOBICITY')

static

Specifies the calculated hydrophobicity contribution of the feature.

Value Type: double

ENVIRONMENT_SUBSTRUCTURE

CDPL.Pharm.FeatureProperty.ENVIRONMENT_SUBSTRUCTURE = CDPL.Base.LookupKey('ENVIRONMENT_SUBSTRUCTURE')

static

Specifies the environment substructure (e.g.

surrounding residues) associated with the feature.

Value Type: Chem.Fragment.SharedPointer

Since

1.4