0.5.1
Pre-release
Pre-release
What's Changed
- Use Sage 2.3.0 in most tests by @mattwthompson in #1412
- [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci[bot] in #1415
- [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci[bot] in #1419
- Build(deps): Bump prefix-dev/setup-pixi from 0.9.3 to 0.9.4 by @dependabot[bot] in #1420
- Fix edge case with combination by @mattwthompson in #1418
- [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci[bot] in #1421
- Turn on import sorting by @mattwthompson in #1424
- [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci[bot] in #1425
- Create OpenMM particles even with no non-bonded handlers by @mattwthompson in #1431
- Clear caches when re-creating from new force fields by @mattwthompson in #1435
- Fix vsite z-coordinate computation by @lilyminium in #1440
- Ensure improper torsions are added to OpenMM, even with no proper torsions by @mattwthompson in #1442
- Use custom 1-4 scaling factors on interactions involving virtual sites by @mattwthompson in #1437
- Use set when storing 1-4 pairs in OpenMM export by @mattwthompson in #1446
- Release 0.5.1 by @mattwthompson in #1449
Full Changelog: v0.5.0...v0.5.1