InChI
 
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tagINChI Struct Reference

#include <ichi.h>

+ Collaboration diagram for tagINChI:

Data Fields

int nErrorCode
 
INCHI_MODE nFlags
 
int nTotalCharge
 
int nNumberOfAtoms
 
char * szHillFormula
 
U_CHARnAtom
 
int lenConnTable
 
AT_NUMBnConnTable
 
int lenTautomer
 
AT_NUMBnTautomer
 
S_CHARnNum_H
 
S_CHARnNum_H_fixed
 
int nNumberOfIsotopicAtoms
 
INChI_IsotopicAtomIsotopicAtom
 
int nNumberOfIsotopicTGroups
 
INChI_IsotopicTGroupIsotopicTGroup
 
INChI_StereoStereo
 
INChI_StereoStereoIsotopic
 
AT_NUMBnPossibleLocationsOfIsotopicH
 
int bDeleted
 
int nRefCount
 
int nLink
 

Field Documentation

◆ bDeleted

int tagINChI::bDeleted

◆ IsotopicAtom

INChI_IsotopicAtom* tagINChI::IsotopicAtom

◆ IsotopicTGroup

INChI_IsotopicTGroup* tagINChI::IsotopicTGroup

◆ lenConnTable

int tagINChI::lenConnTable

◆ lenTautomer

int tagINChI::lenTautomer

◆ nAtom

U_CHAR* tagINChI::nAtom

◆ nConnTable

AT_NUMB* tagINChI::nConnTable

◆ nErrorCode

int tagINChI::nErrorCode

◆ nFlags

INCHI_MODE tagINChI::nFlags

◆ nLink

int tagINChI::nLink

◆ nNum_H

S_CHAR* tagINChI::nNum_H

◆ nNum_H_fixed

S_CHAR* tagINChI::nNum_H_fixed

◆ nNumberOfAtoms

int tagINChI::nNumberOfAtoms

◆ nNumberOfIsotopicAtoms

int tagINChI::nNumberOfIsotopicAtoms

◆ nNumberOfIsotopicTGroups

int tagINChI::nNumberOfIsotopicTGroups

◆ nPossibleLocationsOfIsotopicH

AT_NUMB* tagINChI::nPossibleLocationsOfIsotopicH

◆ nRefCount

int tagINChI::nRefCount

◆ nTautomer

AT_NUMB* tagINChI::nTautomer

◆ nTotalCharge

int tagINChI::nTotalCharge

◆ Stereo

INChI_Stereo* tagINChI::Stereo

◆ StereoIsotopic

INChI_Stereo* tagINChI::StereoIsotopic

◆ szHillFormula

char* tagINChI::szHillFormula

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