RDKit: MolCatalog.h Source File

| RDKit Open-source cheminformatics and machine learning.

- Main Page
- Namespaces
- Classes
- Files

- File List
- File Members

MolCatalog.h
Go to the documentation of this file.
1 //
2 // Copyright (C) 2006 Greg Landrum
3 //
4 //
5 #ifndef _RD_MOL_CATALOG_H_
6 #define _RD_MOL_CATALOG_H_
7
8 #include <Catalogs/Catalog.h>
9 #include <GraphMol/MolCatalog/MolCatalogEntry.h>
10 #include <GraphMol/MolCatalog/MolCatalogParams.h>
11
12 namespace RDKit {
13
14 //! a hierarchical catalog for holding molecules
15 typedef RDCatalog::HierarchCatalog<MolCatalogEntry, MolCatalogParams, int>
16 MolCatalog;
17 }
18
19 #endif
RDKit::MolCatalog
RDCatalog::HierarchCatalog< MolCatalogEntry, MolCatalogParams, int > MolCatalog
a hierarchical catalog for holding molecules
Definition: MolCatalog.h:16
Catalog.h
RDCatalog::HierarchCatalog
A Catalog with a hierarchical structure.
Definition: Catalog.h:134
RDKit
Std stuff.
Definition: Atom.h:29
MolCatalogEntry.h
MolCatalogParams.h