release 0.6.0 - Githubissues

alchemistry / alchemlyb

the simple alchemistry library

https://alchemlyb.readthedocs.io

BSD 3-Clause "New" or "Revised" License

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release 0.6.0 #174

Closed orbeckst closed 2 years ago

orbeckst commented 2 years ago

Cut the 0.6.0 release with AutoMBAR #170, support for Interleaved Double-Wide Sampling (IDWS) in NAMD (PR #135), new time correlation module (PR #168), and subsampling fixes #166.

[x] finalize CHANGES (update API principles, start testing Python 3.10, etc)
[x] twine checked build
[x] tagged source
[x] pypi release
[x] GitHub release

orbeckst commented 2 years ago

Note: also release alchemtest 0.6.0 https://github.com/alchemistry/alchemtest/issues/63

orbeckst commented 2 years ago

Including the automatically created Discussion announcement #182 (and tweet https://twitter.com/orbeckst/status/1476006430201188352 ).