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Release v0.2.0

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@dotsdl dotsdl released this 23 Sep 00:57
· 323 commits to main since this release
535ea22

This release focused on adding documentation for alchemiscale, including a user guide, a first tutorial, deployment, compute, and operations guides, a developer guide, and an API reference. It also added efficient methods for getting network-wide results to the AlchemiscaleClient in #178, and some smaller fixes to the alchemiscale CLI.

What's Changed

  • Fixed version mismatch of alchemiscale in conda environments by @ianmkenney in #165
  • Add user guide to docs, restructure some other documentation pages by @dotsdl in #166
  • Added compute doc, adding other operations docs (e.g. backups) by @dotsdl in #167
  • Support adding and removing multiple scopes from identity with single CLI call by @dotsdl in #172
  • Add developer-facing docs by @dotsdl in #175
  • Review and refinement of API docs by @dotsdl in #177
  • Added get_network_results method to AlchemiscaleClient by @dotsdl in #178
  • Add Alchemiscale Demo as first tutorial by @dotsdl in #174
  • Updated prod-oriented conda envs to use latest openfe, gufe, and python 3.11 by @dotsdl in #181

New Contributors

Full Changelog: v0.1.4...v0.2.0