RDKit
Open-source cheminformatics and machine learning.
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RDKit::v2::FileParsers::TDTMolSupplierParams Struct Reference

#include <MolSupplier.h>

Public Attributes

std::string nameRecord = ""
 
int confId2D = -1
 
int confId3D = -1
 
v2::SmilesParse::SmilesParserParams parseParameters
 

Detailed Description

Definition at line 323 of file MolSupplier.h.

Member Data Documentation

◆ confId2D

int RDKit::v2::FileParsers::TDTMolSupplierParams::confId2D = -1

◆ confId3D

int RDKit::v2::FileParsers::TDTMolSupplierParams::confId3D = -1

◆ nameRecord

std::string RDKit::v2::FileParsers::TDTMolSupplierParams::nameRecord = ""

◆ parseParameters

v2::SmilesParse::SmilesParserParams RDKit::v2::FileParsers::TDTMolSupplierParams::parseParameters
Initial value:
= {
true,
false,
true,
false,
true,
false,
false,
{}
}

Definition at line 327 of file MolSupplier.h.

Referenced by RDKit::v1::TDTMolSupplier::setData(), RDKit::v1::TDTMolSupplier::TDTMolSupplier(), and RDKit::v1::TDTMolSupplier::TDTMolSupplier().


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