RDKit::MolStandardize::Tautomer Class Reference

#include <Tautomer.h>

Public Member Functions
	Tautomer ()
	Tautomer (ROMOL_SPTR t, size_t a=0, size_t b=0)
	Tautomer (ROMOL_SPTR t, ROMOL_SPTR k, size_t a=0, size_t b=0)
const ROMOL_SPTR &	getKekulized () const

Public Attributes
ROMOL_SPTR	tautomer
ROMOL_SPTR	kekulized

Friends
class	TautomerEnumerator

Detailed Description

Definition at line 147 of file MolStandardize/Tautomer.h.

Constructor & Destructor Documentation

Tautomer() [1/3]

RDKit::MolStandardize::Tautomer::Tautomer ( )

inline

Definition at line 151 of file MolStandardize/Tautomer.h.

Tautomer() [2/3]

RDKit::MolStandardize::Tautomer::Tautomer ( ROMOL_SPTR t, size_t a = 0, size_t b = 0 )

inline

Definition at line 153 of file MolStandardize/Tautomer.h.

References tautomer.

Tautomer() [3/3]

RDKit::MolStandardize::Tautomer::Tautomer ( ROMOL_SPTR t, ROMOL_SPTR k, size_t a = 0, size_t b = 0 )

inline

Definition at line 159 of file MolStandardize/Tautomer.h.

References kekulized, and tautomer.

Member Function Documentation

getKekulized()

const ROMOL_SPTR & RDKit::MolStandardize::Tautomer::getKekulized ( ) const

inline

Definition at line 169 of file MolStandardize/Tautomer.h.

References RDKit::MolOps::Kekulize(), kekulized, and tautomer.

Friends And Related Symbol Documentation

TautomerEnumerator

friend class TautomerEnumerator

friend

Definition at line 148 of file MolStandardize/Tautomer.h.

References TautomerEnumerator.

Referenced by TautomerEnumerator.

Member Data Documentation

kekulized

ROMOL_SPTR RDKit::MolStandardize::Tautomer::kekulized

mutable

Definition at line 166 of file MolStandardize/Tautomer.h.

Referenced by getKekulized(), and Tautomer().

tautomer

ROMOL_SPTR RDKit::MolStandardize::Tautomer::tautomer

Definition at line 165 of file MolStandardize/Tautomer.h.

Referenced by getKekulized(), Tautomer(), and Tautomer().

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

• MolStandardize/Tautomer.h