RDKit
Open-source cheminformatics and machine learning.
RDKit::MolHash::HashSet Struct Reference

#include <MolHash.h>

Public Member Functions

 HashSet ()
 

Public Attributes

boost::uint16_t Version
 
boost::uint16_t Reserved
 
boost::uint16_t NumAtoms
 
boost::uint16_t NumBonds
 
boost::uint32_t FormulaCRC32
 
HashCodeType NonChiralAtomsHash
 
HashCodeType NonChiralBondsHash
 
HashCodeType ChiralAtomsHash
 
HashCodeType ChiralBondsHash
 
HashCodeType ChiralityHash
 

Detailed Description

Definition at line 59 of file MolHash.h.

Constructor & Destructor Documentation

RDKit::MolHash::HashSet::HashSet ( )
inline

Member Data Documentation

HashCodeType RDKit::MolHash::HashSet::ChiralAtomsHash

Definition at line 67 of file MolHash.h.

HashCodeType RDKit::MolHash::HashSet::ChiralBondsHash

Definition at line 68 of file MolHash.h.

HashCodeType RDKit::MolHash::HashSet::ChiralityHash

Definition at line 69 of file MolHash.h.

boost::uint32_t RDKit::MolHash::HashSet::FormulaCRC32

Definition at line 64 of file MolHash.h.

HashCodeType RDKit::MolHash::HashSet::NonChiralAtomsHash

Definition at line 65 of file MolHash.h.

HashCodeType RDKit::MolHash::HashSet::NonChiralBondsHash

Definition at line 66 of file MolHash.h.

boost::uint16_t RDKit::MolHash::HashSet::NumAtoms

Definition at line 62 of file MolHash.h.

boost::uint16_t RDKit::MolHash::HashSet::NumBonds

Definition at line 63 of file MolHash.h.

boost::uint16_t RDKit::MolHash::HashSet::Reserved

Definition at line 61 of file MolHash.h.

boost::uint16_t RDKit::MolHash::HashSet::Version

Definition at line 60 of file MolHash.h.


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