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Chemical Data Processing Library C++ API - Version 1.1.1
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29 #ifndef CDPL_CONFGEN_TORSIONRULEMATCH_HPP
30 #define CDPL_CONFGEN_TORSIONRULEMATCH_HPP
76 #endif // CDPL_CONFGEN_TORSIONRULEMATCH_HPP
const Chem::Atom *const * getAtoms() const
Bond.
Definition: Bond.hpp:50
Definition: TorsionRule.hpp:47
Atom.
Definition: Atom.hpp:52
const TorsionRule & getRule() const
Definition: TorsionRuleMatch.hpp:55
Definition of the preprocessor macro CDPL_CONFGEN_API.
Definition of the class CDPL::Chem::MolecularGraph.
const Chem::Bond & getBond() const
#define CDPL_CONFGEN_API
Tells the compiler/linker which classes, functions and variables are part of the library API.
The namespace of the Chemical Data Processing Library.
TorsionRuleMatch(const TorsionRule &rule, const Chem::Bond &bond, const Chem::Atom *atom1, const Chem::Atom *atom2, const Chem::Atom *atom3, const Chem::Atom *atom4)