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RDKit
Open-source cheminformatics and machine learning.
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various tools for iterating over a molecule's Atoms. More...
#include <RDGeneral/export.h>Go to the source code of this file.
Classes | |
| class | RDKit::AtomIterator_< Atom_, Mol_ > |
| A general random access iterator. More... | |
| class | RDKit::HeteroatomIterator_< Atom_, Mol_ > |
| Iterate over heteroatoms, this is bidirectional. More... | |
| class | RDKit::AromaticAtomIterator_< Atom_, Mol_ > |
| Iterate over aromatic atoms, this is bidirectional. More... | |
| class | RDKit::QueryAtomIterator_< Atom_, Mol_ > |
| Iterate over atoms matching a query. This is bidirectional. More... | |
| class | RDKit::MatchingAtomIterator_< Atom_, Mol_ > |
| Iterate over atoms matching a query function. This is bidirectional. More... | |
Namespaces | |
| namespace | RDKit |
| Std stuff. | |
various tools for iterating over a molecule's Atoms.
WARNING: If you go changing the molecule underneath one of these iterators you will be sad...
Definition in file AtomIterators.h.