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RDKit
Open-source cheminformatics and machine learning.
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#include <map>#include <string>#include <RDGeneral/Invariant.h>#include <sstream>#include <RDGeneral/Exceptions.h>#include <RDGeneral/StreamOps.h>#include <boost/cstdint.hpp>Go to the source code of this file.
Classes | |
| class | RDKit::SparseIntVect< IndexType > |
| a class for efficiently storing sparse vectors of ints More... | |
Namespaces | |
| RDKit | |
| Includes a bunch of functionality for handling Atom and Bond queries. | |
Functions | |
| template<typename IndexType , typename SequenceType > | |
| void | RDKit::updateFromSequence (SparseIntVect< IndexType > &vect, const SequenceType &seq) |
| template<typename IndexType > | |
| double | RDKit::DiceSimilarity (const SparseIntVect< IndexType > &v1, const SparseIntVect< IndexType > &v2, bool returnDistance=false, double bounds=0.0) |
| template<typename IndexType > | |
| double | RDKit::TverskySimilarity (const SparseIntVect< IndexType > &v1, const SparseIntVect< IndexType > &v2, double a, double b, bool returnDistance=false, double bounds=0.0) |
| template<typename IndexType > | |
| double | RDKit::TanimotoSimilarity (const SparseIntVect< IndexType > &v1, const SparseIntVect< IndexType > &v2, bool returnDistance=false, double bounds=0.0) |
Variables | |
| const int | ci_SPARSEINTVECT_VERSION |
| version number to use in pickles More... | |
| const int ci_SPARSEINTVECT_VERSION |
version number to use in pickles
Definition at line 22 of file SparseIntVect.h.
Referenced by RDKit::SparseIntVect< IndexType >::toString().