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diff --git a/docs/descriptor.rst b/docs/descriptor.rst new file mode 100644 index 0000000..0662c2e --- /dev/null +++ b/docs/descriptor.rst @@ -0,0 +1,29 @@ +.. highlight:: rest + +.. _descriptor_module: + +The :mod:`modelcif.descriptor` Python module +============================================ + +.. automodule:: modelcif.descriptor + +.. autoclass:: Descriptor + :members: + +.. autoclass:: CanonicalSMILES + :members: + +.. autoclass:: IsomericSMILES + :members: + +.. autoclass:: IUPACName + :members: + +.. autoclass:: InChI + :members: + +.. autoclass:: InChIKey + :members: + +.. autoclass:: PubChemCID + :members: |