RDKit
Open-source cheminformatics and machine learning.
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#include <MolSupplier.h>
Public Attributes | |
std::string | nameRecord = "" |
int | confId2D = -1 |
int | confId3D = -1 |
v2::SmilesParse::SmilesParserParams | parseParameters |
Definition at line 322 of file MolSupplier.h.
int RDKit::v2::FileParsers::TDTMolSupplierParams::confId2D = -1 |
Definition at line 324 of file MolSupplier.h.
Referenced by RDKit::v1::TDTMolSupplier::setData(), RDKit::v1::TDTMolSupplier::TDTMolSupplier(), and RDKit::v1::TDTMolSupplier::TDTMolSupplier().
int RDKit::v2::FileParsers::TDTMolSupplierParams::confId3D = -1 |
Definition at line 325 of file MolSupplier.h.
Referenced by RDKit::v1::TDTMolSupplier::setData(), RDKit::v1::TDTMolSupplier::TDTMolSupplier(), and RDKit::v1::TDTMolSupplier::TDTMolSupplier().
std::string RDKit::v2::FileParsers::TDTMolSupplierParams::nameRecord = "" |
Definition at line 323 of file MolSupplier.h.
Referenced by RDKit::GeneralMolSupplier::getSupplier(), RDKit::v1::TDTMolSupplier::setData(), RDKit::v1::TDTMolSupplier::TDTMolSupplier(), and RDKit::v1::TDTMolSupplier::TDTMolSupplier().
v2::SmilesParse::SmilesParserParams RDKit::v2::FileParsers::TDTMolSupplierParams::parseParameters |
Definition at line 326 of file MolSupplier.h.
Referenced by RDKit::v1::TDTMolSupplier::setData(), RDKit::v1::TDTMolSupplier::TDTMolSupplier(), and RDKit::v1::TDTMolSupplier::TDTMolSupplier().