RDKit
Open-source cheminformatics and machine learning.
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Public Member Functions | Public Attributes | List of all members
RDKit::MolStandardize::ChargeCorrection Struct Reference

#include <Charge.h>

Public Member Functions

 ChargeCorrection (std::string name, std::string smarts, int charge)
 

Public Attributes

std::string Name
 
std::string Smarts
 
int Charge
 

Detailed Description

Definition at line 38 of file Charge.h.

Constructor & Destructor Documentation

◆ ChargeCorrection()

RDKit::MolStandardize::ChargeCorrection::ChargeCorrection ( std::string name,
std::string smarts,
int charge )
inline

Definition at line 43 of file Charge.h.

Member Data Documentation

◆ Charge

int RDKit::MolStandardize::ChargeCorrection::Charge

Definition at line 41 of file Charge.h.

◆ Name

std::string RDKit::MolStandardize::ChargeCorrection::Name

Definition at line 39 of file Charge.h.

◆ Smarts

std::string RDKit::MolStandardize::ChargeCorrection::Smarts

Definition at line 40 of file Charge.h.

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