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0.5.3
Pre-release
Pre-release
What's Changed
- Bump aws-actions/configure-aws-credentials from 5 to 6 by @dependabot[bot] in #725
- Use SetupTools 81 in CI by @mattwthompson in #731
- Remove smirnoff99frosst by @lilyminium in #730
- Add selectnumrepresentations filter by @lilyminium in #724
- Avoid
xmltodict1.0.3 by @mattwthompson in #736 - Forbid
ASHresidue name by @mattwthompson in #739 - Allow for empty topology labels for inapplicable keys by @lilyminium in #734
- Add runtime limit to AWS instances by @j-wags in #741
- allow valence and nagl parameters by @lilyminium in #733
- Extend ParameterGradientKey to accommodate virtual sites by @lilyminium in #742
- Remove Pint constraint in test environment by @mattwthompson in #746
Full Changelog: v0.5.2...v0.5.3