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schwede
openstructure
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0e5e3388
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0e5e3388
authored
1 year ago
by
Studer Gabriel
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mmcif writer: docu update
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a5c5c722
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modules/io/doc/mmcif.rst
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modules/io/doc/mmcif.rst
modules/io/pymod/__init__.py
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modules/io/pymod/__init__.py
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modules/io/doc/mmcif.rst
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@@ -1594,6 +1594,8 @@ The content of the written file:
:type filename: :class:`str`
.. _MMCif writing:
mmCIF Writer
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
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modules/io/pymod/__init__.py
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@@ -468,7 +468,7 @@ def SaveMMCIF(ent, filename, data_name="OST_structure", mmcif_conform = True):
identifier.
:param mmcif_conform: Controls processing of structure, i.e. identification
of mmCIF entities etc. before writing. Detailed
description i
s in the documentation below
. In short:
description i
n :ref:`MMCif writing`
. In short:
If *mmcif_conform* is set to True, Chains in *ent* are
expected to be valid mmCIF entities with residue numbers
set according to underlying SEQRES. That should be the
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