* Updated the README file to give a better description. * Updated the short description in setup.py to work with the new installer. * Added keywords for better searchability.
2021.2.4
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* Updated for compatibility with the new system classes in MolSystem 2021.2.2 release.
2020.12.5
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* Internal: switching CI from TravisCI to GitHub Actions, and in the process moving documentation from ReadTheDocs to GitHub Pages where it is consolidated with the main SEAMM documentation.
2020.11.2
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* Updated to be compatible with the new command-line argument handling.
2020.9.28
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* Improved handling of results
- Selection depends on both calculation and method. - Arrays can be stored in variables (but not tables!). - Multipoles gathered as arrays rather than a large number of scalars.