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RDKit
Open-source cheminformatics and machine learning.
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Go to the source code of this file.
Classes | |
class | RDKit::ConformerException |
used to indicate errors from incorrect confomer access More... | |
class | RDKit::Conformer |
The class for representing 2D or 3D conformation of a molecule. More... | |
Namespaces | |
RDKit | |
Includes a bunch of functionality for handling Atom and Bond queries. | |
Typedefs | |
typedef boost::shared_ptr< Conformer > | RDKit::CONFORMER_SPTR |