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 | OEChem - Python Theory Manual
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| OEChem - Python Theory Manual
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Molecules in OEChem are represented by OEMolBases. In addition to keeping track of the atoms and bonds that constitute a molecule, the OEMolBase is also used to store global information about the molecule. The stored (read-write) properties of a molecule are listed below:
| Property Name | Type | Set Method | Get Method |
| Dimension | int | SetDimension | GetDimension |
| Energy | float | SetEnergy | GetEnergy |
| Rxn | 0 or 1 | SetRxn | IsRxn |
| Title | string | SetTitle | GetTitle |
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| OEChem - Python Theory Manual
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