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RDKit
Open-source cheminformatics and machine learning.
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RDKit
Open-source cheminformatics and machine learning.
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#include <ZMatrix.h>
Public Attributes | |
| std::optional< double > | length |
| std::optional< unsigned int > | bondRef |
| std::optional< double > | angle |
| std::optional< unsigned int > | angleRef |
| std::optional< TorsionCandidates > | torsion |
| std::optional< unsigned int > | torsionRef |
| std::optional<double> DistGeom::ZMatrix::InternalCoordinateReference::angle |
| std::optional<unsigned int> DistGeom::ZMatrix::InternalCoordinateReference::angleRef |
| std::optional<unsigned int> DistGeom::ZMatrix::InternalCoordinateReference::bondRef |
| std::optional<double> DistGeom::ZMatrix::InternalCoordinateReference::length |
| std::optional<TorsionCandidates> DistGeom::ZMatrix::InternalCoordinateReference::torsion |
| std::optional<unsigned int> DistGeom::ZMatrix::InternalCoordinateReference::torsionRef |
1.17.0