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schwede
openstructure
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4c65011b
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4c65011b
authored
13 years ago
by
Tobias Schmidt
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added python documentation for chemtype
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modules/mol/base/doc/entity.rst
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@@ -511,6 +511,12 @@ The Handle Classes
The chemical class of a residue is used to broadly categorize residues based
on their chemical properties. For example, peptides belong to the
`L_PEPTIDE_LINKING` or `D_PEPTIDE_LINKING` classes.
.. attribute:: chem_type
The chemical type of a residue is a classification of all compounds
obtained from the PDB component dictionary. For example, ions belong to the
class `ChemType::IONS`, amino acids to `ChemType::AMINOACIDS`.
.. attribute:: sec_structure
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@@ -559,6 +565,9 @@ The Handle Classes
See :attr:`psi_torsion`
.. method:: GetChemType()
See :attr:`chem_type`
.. class:: AtomHandle
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