Changelog for humans
This release introduces the ability to resume execution of an incomplete transformation using openfe quickrun with the --resume flag. See the quickrun documentation for more details.
https://docs.openfree.energy/en/latest/CHANGELOG.html#v1-10-0
All PRs included in this release:
What's Changed
- add xfail to ahfe cpu test by @atravitz in #1851
- deprecate perses functionality by @atravitz in #1857
- Update openfe analysis pin by @mikemhenry in #1859
- pin interchange by @atravitz in #1860
- small typing fix to make mypy happy by @atravitz in #1865
- Add resume support to HybridTop simulation unit by @IAlibay in #1774
- Use GitHub API to fetch latest release/version by @mikemhenry in #1870
- Add resuming support in AFE Protocols by @IAlibay in #1808
- Don't use the CUDA platform by default in tests by @IAlibay in #1881
- update abfe test data by @atravitz in #1862
- Fixing various typos by @IAlibay in #1882
- tests: migrate from using deprecated
tmpdirto preferredtmp_pathby @atravitz in #1873 - quickrun testing: check default filename creation by @atravitz in #1898
- min pin interchange by @atravitz in #1901
- Modify quickrun to allow resuming by @IAlibay in #1848
- update feedstock CI test for v1 by @atravitz in #1900
- unify CI runner naming conventions by @atravitz in #1904
- CI: add feedstock build test by @atravitz in #1905
- Fix typo in quickrun execution error message. by @IAlibay in #1906
- Update the userguide CLI docs to mention resuming by @IAlibay in #1878
- Release v1.10.0 by @atravitz in #1902
Full Changelog: v1.9.1...v1.10.0