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@j-wags j-wags released this 07 Nov 21:08
· 3 commits to main since this release
0.54.0
0feb298
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Learn about vigilant mode.

What's Changed

  • Use get to avoid KeyError on missing cmiles attribute by @ntBre in #300
  • Use new Pydantic v1 backdoor by @mattwthompson in #295
  • Update OptimizationResultCollection.create_basic_dataset to preserve molecule IDs by @ntBre in #303

Full Changelog: 0.53.0...0.54.0

Contributors

mattwthompson and ntBre
Assets 2
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