RDKit: RDKit::Canon::ChiralAtomCompareFunctor Class Reference

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RDKit::Canon::ChiralAtomCompareFunctor Class Reference

`#include <new_canon.h>`

## Public Member Functions
| ChiralAtomCompareFunctor ()
| ChiralAtomCompareFunctor (Canon::canon_atom *atoms, const ROMol &m)
int | operator() (int i, int j) const

## Public Attributes
Canon::canon_atom * | dp_atoms
const ROMol * | dp_mol
bool | df_useNbrs

## Detailed Description

Definition at line 442 of file new_canon.h.

## Constructor & Destructor Documentation

RDKit::Canon::ChiralAtomCompareFunctor::ChiralAtomCompareFunctor | ( |  | ) |
| inline

Definition at line 511 of file new_canon.h.

RDKit::Canon::ChiralAtomCompareFunctor::ChiralAtomCompareFunctor | ( | Canon::canon_atom * | atoms,
|  | const ROMol & | m
| ) |  |
| inline

Definition at line 513 of file new_canon.h.

## Member Function Documentation

int RDKit::Canon::ChiralAtomCompareFunctor::operator() | ( | int | i,
|  | int | j
| ) |  | const
| inline

Definition at line 515 of file new_canon.h.

References RDKit::Canon::canon_atom::bonds, RDKit::Canon::bondholder::compare(), and PRECONDITION.

## Member Data Documentation

bool RDKit::Canon::ChiralAtomCompareFunctor::df_useNbrs

Definition at line 510 of file new_canon.h.

Canon::canon_atom* RDKit::Canon::ChiralAtomCompareFunctor::dp_atoms

Definition at line 508 of file new_canon.h.

const ROMol* RDKit::Canon::ChiralAtomCompareFunctor::dp_mol

Definition at line 509 of file new_canon.h.

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

- new_canon.h