![]() |
RDKit
Open-source cheminformatics and machine learning.
|
#include <MolSupplier.h>
Public Attributes | |
| std::string | nameRecord = "" |
| int | confId2D = -1 |
| int | confId3D = -1 |
| v2::SmilesParse::SmilesParserParams | parseParameters |
Definition at line 544 of file MolSupplier.h.
| int RDKit::v2::FileParsers::TDTMolSupplierParams::confId2D = -1 |
Definition at line 546 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 547 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 545 of file MolSupplier.h.
Referenced by RDKit::v1::TDTMolSupplier::setData(), RDKit::v1::TDTMolSupplier::TDTMolSupplier(), and RDKit::v1::TDTMolSupplier::TDTMolSupplier().
| v2::SmilesParse::SmilesParserParams RDKit::v2::FileParsers::TDTMolSupplierParams::parseParameters |
Definition at line 548 of file MolSupplier.h.
Referenced by RDKit::v1::TDTMolSupplier::setData(), RDKit::v1::TDTMolSupplier::TDTMolSupplier(), and RDKit::v1::TDTMolSupplier::TDTMolSupplier().