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0.13.0 Temporarily remove GAFFTemplateGenerator

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@mikemhenry mikemhenry released this 03 May 20:51
· 126 commits to main since this release
f943979

0.13.0 Temporarily remove GAFFTemplateGenerator

This release temporarily removes GAFFTemplateGenerator because of packaging incompatibilities with
AmberTools 23. This functionality is planned to be re-introduced in 0.14.0.

This release is expected to work with Python 3.10-3.12.

Other changes include

  • The default force field of SystemGenerator was updated from openff-1.0.0 (code name Parsley) to
    openff-2.0.0 (code name Sage).

What's Changed

New Contributors

Full Changelog: 0.12.0...0.13.0