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0.6.6

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@hadim hadim released this 17 Feb 21:43
· 716 commits to main since this release

Added:

  • Add dm.conformers.align_conformers() to align the conformers of a list of molecules.

Changed:

  • New lower bound rdkit version to >=2021.09. See #81 for details.

Authors:

  • Hadrien Mary