CDPL.Chem.PatternBasedTautomerizationRule Class Reference

PatternBasedTautomerizationRule. More...

Inheritance diagram for CDPL.Chem.PatternBasedTautomerizationRule:

Classes
class	BondOrderChange

Public Member Functions
None	__init__ (int id)
	Initializes the PatternBasedTautomerizationRule instance. More...
None	__init__ (PatternBasedTautomerizationRule rule)
	Initializes a copy of the PatternBasedTautomerizationRule instance rule. More...
None	addTransformationPattern (MolecularGraph molgraph, object bond_chgs)
None	addExcludePattern (MolecularGraph molgraph)
None	addExcludePatterns (PatternBasedTautomerizationRule rule)
None	clearExcludePatterns ()
PatternBasedTautomerizationRule	assign (PatternBasedTautomerizationRule rule)
	Replaces the current state of self with a copy of the state of the PatternBasedTautomerizationRule instance rule. More...
Public Member Functions inherited from CDPL.Chem.TautomerizationRule
None	__init__ ()
	Initializes the TautomerizationRule instance.
int	getObjectID ()
	Returns the numeric identifier (ID) of the wrapped C++ class instance. More...
int	getID ()
bool	setup (MolecularGraph parent_molgraph)
bool	generate (Molecule tautomer)
	Generates the next tautomer. More...
TautomerizationRule	clone ()

Additional Inherited Members
Properties inherited from CDPL.Chem.TautomerizationRule
	objectID = property(getObjectID)

Detailed Description

PatternBasedTautomerizationRule.

Constructor & Destructor Documentation

__init__() [1/2]

None CDPL.Chem.PatternBasedTautomerizationRule.__init__

(

int

id

)

Initializes the PatternBasedTautomerizationRule instance.

Parameters

id

__init__() [2/2]

None CDPL.Chem.PatternBasedTautomerizationRule.__init__

(

PatternBasedTautomerizationRule

rule

)

Initializes a copy of the PatternBasedTautomerizationRule instance rule.

Parameters

rule	The PatternBasedTautomerizationRule instance to copy.

Member Function Documentation

addTransformationPattern()

None CDPL.Chem.PatternBasedTautomerizationRule.addTransformationPattern	(	MolecularGraph	molgraph,
		object	bond_chgs
	)

Parameters

molgraph
bond_chgs

addExcludePattern()

None CDPL.Chem.PatternBasedTautomerizationRule.addExcludePattern

(

MolecularGraph

molgraph

)

Parameters

molgraph

addExcludePatterns()

None CDPL.Chem.PatternBasedTautomerizationRule.addExcludePatterns

(

PatternBasedTautomerizationRule

rule

)

Parameters

rule

assign()

PatternBasedTautomerizationRule CDPL.Chem.PatternBasedTautomerizationRule.assign

(

PatternBasedTautomerizationRule

rule

)

Replaces the current state of self with a copy of the state of the PatternBasedTautomerizationRule instance rule.

Parameters

rule	The PatternBasedTautomerizationRule instance to copy.

Returns

self