Chemical Data Processing Library C++ API - Version 1.1.1
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Definition of the class CDPL::Chem::ChEMBLStandardizer. More...
#include <vector>
#include <cstdint>
#include <utility>
#include <unordered_set>
#include <memory>
#include <boost/functional/hash.hpp>
#include "CDPL/Chem/APIPrefix.hpp"
#include "CDPL/Chem/BasicMolecule.hpp"
#include "CDPL/Chem/Fragment.hpp"
#include "CDPL/Chem/KekuleStructureCalculator.hpp"
#include "CDPL/Chem/SubstructureSearch.hpp"
#include "CDPL/Chem/HashCodeCalculator.hpp"
#include "CDPL/Chem/ProtonationStateStandardizer.hpp"
#include "CDPL/Util/BitSet.hpp"
#include "CDPL/Math/VectorArray.hpp"
Go to the source code of this file.
Classes | |
class | CDPL::Chem::ChEMBLStandardizer |
Implementation of the ChEMBL structure preprocessing pipeline. More... | |
Namespaces | |
CDPL | |
The namespace of the Chemical Data Processing Library. | |
CDPL::Chem | |
Contains classes and functions related to chemistry. | |
Definition of the class CDPL::Chem::ChEMBLStandardizer.