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Chemical Data Processing Library C++ API - Version 1.1.1
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29 #ifndef CDPL_MOLPROP_HBONDACCEPTORATOMTYPER_HPP
30 #define CDPL_MOLPROP_HBONDACCEPTORATOMTYPER_HPP
63 #endif // CDPL_MOLPROP_HBONDACCEPTORATOMTYPER_HPP
std::shared_ptr< HBondAcceptorAtomTyper > SharedPointer
Definition: HBondAcceptorAtomTyper.hpp:49
MolecularGraph.
Definition: MolecularGraph.hpp:52
Definition of the class CDPL::Util::Array.
Definition of the class CDPL::Chem::PatternAtomTyper.
Definition: HBondAcceptorAtomTyper.hpp:46
PatternAtomTyper.
Definition: PatternAtomTyper.hpp:52
The namespace of the Chemical Data Processing Library.
Definition of the preprocessor macro CDPL_MOLPROP_API.
#define CDPL_MOLPROP_API
Tells the compiler/linker which classes, functions and variables are part of the library API.
HBondAcceptorAtomTyper(const Chem::MolecularGraph &molgraph, Util::UIArray &types)
Array< unsigned int > UIArray
An array of unsigned integers.
Definition: Array.hpp:562
void perceiveTypes(const Chem::MolecularGraph &molgraph, Util::UIArray &types)