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contains SMARTS definitions and calculators for EState atom types defined in: Hall and Kier JCICS _35_ 1039-1045 (1995) Table 1
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_rawD =
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esPatterns = None
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__package__ =
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Imports: Chem
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assigns each atom in a molecule to an EState type **Returns:** list of tuples (atoms can possibly match multiple patterns) with atom types |
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_rawD
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