RDKit::MolStandardize::TautomerCatalogParams Class Reference

#include <TautomerCatalogParams.h>

Inheritance diagram for RDKit::MolStandardize::TautomerCatalogParams:

Public Member Functions
	TautomerCatalogParams ()
	TautomerCatalogParams (const std::string &tautomerFile)
	TautomerCatalogParams (const TautomerTransformDefs &data)
	TautomerCatalogParams (const TautomerCatalogParams &other)
	~TautomerCatalogParams () override
const std::vector< TautomerTransform > &	getTransforms () const
const TautomerTransform	getTransform (unsigned int fid) const
void	toStream (std::ostream &) const override
	serializes (pickles) to a stream
std::string	Serialize () const override
	returns a string with a serialized (pickled) representation
void	initFromStream (std::istream &ss) override
	initializes from a stream pickle
void	initFromString (const std::string &text) override
	initializes from a string pickle
Public Member Functions inherited from RDCatalog::CatalogParams
virtual	~CatalogParams ()=0
std::string	getTypeStr () const
	returns our type string
void	setTypeStr (const std::string &typeStr)
	sets our type string

Additional Inherited Members
Protected Attributes inherited from RDCatalog::CatalogParams
std::string	d_typeStr
	our type string

Detailed Description

Definition at line 36 of file TautomerCatalogParams.h.

Constructor & Destructor Documentation

TautomerCatalogParams() [1/4]

RDKit::MolStandardize::TautomerCatalogParams::TautomerCatalogParams ( )

inline

Definition at line 39 of file TautomerCatalogParams.h.

TautomerCatalogParams() [2/4]

RDKit::MolStandardize::TautomerCatalogParams::TautomerCatalogParams

(

const std::string &

tautomerFile

)

TautomerCatalogParams() [3/4]

RDKit::MolStandardize::TautomerCatalogParams::TautomerCatalogParams

(

const TautomerTransformDefs &

data

)

TautomerCatalogParams() [4/4]

RDKit::MolStandardize::TautomerCatalogParams::TautomerCatalogParams

(

const TautomerCatalogParams &

other

)

~TautomerCatalogParams()

RDKit::MolStandardize::TautomerCatalogParams::~TautomerCatalogParams ( )

override

Member Function Documentation

getTransform()

const TautomerTransform RDKit::MolStandardize::TautomerCatalogParams::getTransform

(

unsigned int

fid

)

const

getTransforms()

const std::vector< TautomerTransform > & RDKit::MolStandardize::TautomerCatalogParams::getTransforms

(

)

const

initFromStream()

void RDKit::MolStandardize::TautomerCatalogParams::initFromStream ( std::istream &  ss )

overridevirtual

initializes from a stream pickle

Implements RDCatalog::CatalogParams.

initFromString()

void RDKit::MolStandardize::TautomerCatalogParams::initFromString ( const std::string &  text )

overridevirtual

initializes from a string pickle

Implements RDCatalog::CatalogParams.

Serialize()

std::string RDKit::MolStandardize::TautomerCatalogParams::Serialize ( ) const

overridevirtual

returns a string with a serialized (pickled) representation

Implements RDCatalog::CatalogParams.

toStream()

void RDKit::MolStandardize::TautomerCatalogParams::toStream ( std::ostream &  ) const

overridevirtual

serializes (pickles) to a stream

Implements RDCatalog::CatalogParams.

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

• TautomerCatalogParams.h