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Releases: MolSSI/QCElemental

v0.2.3

29 Jan 15:14
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Update models to be compatible with QCFractal and MongoDB objects in the QCArchive Ecosystem.

Also enhances the Molecule model's json function to accept as_dict=bool keyword, permitting a return as a dictionary of Pydantic-serialized python (primitive) objects, instead of a json-compatible string

v0.2.2

28 Jan 20:02
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Ensure json encoders are passed through qcelemental

Pydantic does not carry the json_encoders up through nested BaseModels,
this becomes an issue on the QCEngine side when casting the Pydantic
objects to JSON objects.

This also adds tests to the ensure serialization is consistent

v0.2.1

27 Jan 22:19
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Update setup.py

v0.2.0

25 Jan 22:27
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Adds Pydantic to dependencies
Requires Python 3.6+ from this point forward

v0.1.3

14 Dec 20:45
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v0.1.3

v0.1.2

05 Nov 16:26
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v0.1.1

30 Oct 19:18
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v0.1.0a

24 Oct 17:05
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