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Package joelib.data
| Class Summary | |
| JOEAromaticTyper | Aromatic typer. |
| JOEAtomTyper | Atom typer based on structural expert rules. |
| JOEChemTransformation | Transformation of chemical groups. |
| JOECommentData | Comment data. |
| JOEDataType | Data type. |
| JOEElementTable | Element table. |
| JOEExternalBond | External bond. |
| JOEExternalBondData | External bond data. |
| JOEGenericData | Base class for generic data elements. |
| JOEGlobalDataBase | Base class for handling JOELib data. |
| JOEGroupContribution | Holds group contribution lists for different models (e.g. |
| JOEIsotopeTable | Isotope element table. |
| JOEPairData | Use to store attribute/value relationships. |
| JOEPhModel | Model for the protonation/deprotonation of molecules. |
| JOEResidueData | Type table. |
| JOERgroupData | Stores Rgroup data. |
| JOETypeTable | Type table to map internal atom types to atom types of other file formats. |
| JOEVirtualBond | Virtual bond. |
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