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CHANGELOG.rst

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Changelog

0.3.3 (2023/09/18)

  • Debug like 0.3.1 (add path to general_config in diffusion.py and main.py)

0.3.2 (2023/09/18)

  • Debug like 0.3.1

0.3.1 (2023/09/18)

  • Debug folder structure when calling some functions
  • Add example script and notebook

0.3.0 (2023/09/18)

  • Debugging, additional plots
  • More configuration options with more datasets
  • New scripts (Tanimoto similarity, plot datasets)

0.2.1 (2023/08/13)

  • Debug the initial release of the package.

0.2.0 (2023/08/13)

  • Debug the initial release of the package.

0.1.0 (2023/08/10)

  • Version 1 of the CCSD Python package.