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25 changes: 25 additions & 0 deletions docs/CHANGELOG.rst
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Expand Up @@ -4,6 +4,31 @@ CHANGELOG

.. current developments

v1.12.0
====================

**Added:**

* Added support for Python 3.14 (`PR #796 <https://github.com/OpenFreeEnergy/gufe/pull/796>`_).
* Unpickling gufe tokenizables now supports the gufe token registry (`PR #797 <https://github.com/OpenFreeEnergy/gufe/pull/797>`_).
* ``Transformation`` and ``NonTransformation`` classes now have a ``metadata`` property.
This property is a dictionary with ``str`` keys mapping to any values with a ``gufe`` serializable type (`PR #789 <https://github.com/OpenFreeEnergy/gufe/pull/789>`_).

**Deprecated:**

* The removal timeline for the already-deprecated
``LigandNetwork.to_rbfe_alchemical_network()`` has been updated from
gufe v2.0 to gufe v1.13.0 (`PR #793 <https://github.com/OpenFreeEnergy/gufe/pull/793>`_).

**Fixed:**

* Normalized serialized ``pathlib.PosixPath`` objects to use the public ``pathlib`` module name while continuing to read the Python 3.13 ``pathlib._local`` form (`PR #796 <https://github.com/OpenFreeEnergy/gufe/pull/796>`_).
* Fixed pickling of ``SmallMoleculeComponent``/``ExplicitMoleculeComponent`` objects so RDKit molecule properties, such as ``_Name``, are preserved across serialization round-trips.
This will fix issues from using multiprocessing with these objects (`PR #797 <https://github.com/OpenFreeEnergy/gufe/pull/797>`_).
* ``Transformations`` and ``NonTransformations`` now call the initialization of the parent ``TransformationBase``.
This fix doesn't affect behavior of the classes as implemented in gufe, but may affect external classes that inherit from them (`PR #798 <https://github.com/OpenFreeEnergy/gufe/pull/798>`_).


v1.11.0
====================

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