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v0.2.7

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@PythonFZ PythonFZ released this 02 Oct 22:01
7d1d161

What's Changed

  • fix: raise ValueError for unparseable SMILES and short conformer embeddings by @PythonFZ in #130
  • perf: compute ase2networkx bonds from sparse neighbor pairs by @PythonFZ in #132
  • feat: add molify.repeat to tile periodic boxes with their connectivity by @PythonFZ in #131
  • refactor: read atoms.info['connectivity'] through one shared helper by @PythonFZ in #133
  • chore: upgrade locked dependencies and pre-commit hooks by @PythonFZ in #136

Full Changelog: v0.2.6...v0.2.7