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0.1.0
The release incorporates very important new features:
- Added Allegro and So3krates as new possible architectures, as well as a complete new design of MACE based on the current version.
- Update the pytorch lightning version from 1.9.4 to 2.2.1. We include
scripts/mlcg-adapt-training-yaml.pyto adapt old training yaml scripts. - Add automatic testing of the examples.