InChI
 
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tagOrigAtom Struct Reference

#include <inpdef.h>

+ Collaboration diagram for tagOrigAtom:

Data Fields

inp_ATOMat
 
int num_dimensions
 
int num_inp_bonds
 
int num_inp_atoms
 
int num_components
 
int bDisconnectSalts
 
int bDisconnectCoord
 
AT_NUMBnCurAtLen
 
AT_NUMBnOldCompNumber
 
int nNumEquSets
 
AT_NUMBnEquLabels
 
AT_NUMBnSortedOrder
 
int bSavedInINCHI_LIB [INCHI_NUM]
 
int bPreprocessed [INCHI_NUM]
 
MOL_COORDszCoord
 
OAD_Polymerpolymer
 
OAD_V3000v3000
 
int valid_polymer
 
int n_zy
 

Field Documentation

◆ at

inp_ATOM* tagOrigAtom::at

◆ bDisconnectCoord

int tagOrigAtom::bDisconnectCoord

◆ bDisconnectSalts

int tagOrigAtom::bDisconnectSalts

◆ bPreprocessed

int tagOrigAtom::bPreprocessed[INCHI_NUM]

◆ bSavedInINCHI_LIB

int tagOrigAtom::bSavedInINCHI_LIB[INCHI_NUM]

◆ n_zy

int tagOrigAtom::n_zy

◆ nCurAtLen

AT_NUMB* tagOrigAtom::nCurAtLen

◆ nEquLabels

AT_NUMB* tagOrigAtom::nEquLabels

◆ nNumEquSets

int tagOrigAtom::nNumEquSets

◆ nOldCompNumber

AT_NUMB* tagOrigAtom::nOldCompNumber

◆ nSortedOrder

AT_NUMB* tagOrigAtom::nSortedOrder

◆ num_components

int tagOrigAtom::num_components

◆ num_dimensions

int tagOrigAtom::num_dimensions

◆ num_inp_atoms

int tagOrigAtom::num_inp_atoms

◆ num_inp_bonds

int tagOrigAtom::num_inp_bonds

◆ polymer

OAD_Polymer* tagOrigAtom::polymer

◆ szCoord

MOL_COORD* tagOrigAtom::szCoord

◆ v3000

OAD_V3000* tagOrigAtom::v3000

◆ valid_polymer

int tagOrigAtom::valid_polymer

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