Published January 2, 2025 | Version v2.0.5-alpha
Software Open

datamol-io/medchem: Molecular filtering for drug discovery

Authors/Creators

  • 1. Valence Labs
  • 2. Octant Bio
  • 3. @valence-labs
  • 4. Valence Labs @ Recursion Pharmaceuticals

Description

What's Changed

  • fix: Remove compromised link to polyfill.io by @jstlaurent in https://github.com/datamol-io/medchem/pull/24
  • Enable batch parallelization for CommonAlertsFilters by @kkovary in https://github.com/datamol-io/medchem/pull/28
  • linting with black by @maclandrol in https://github.com/datamol-io/medchem/pull/29

New Contributors

  • @jstlaurent made their first contribution in https://github.com/datamol-io/medchem/pull/24
  • @kkovary made their first contribution in https://github.com/datamol-io/medchem/pull/28

Full Changelog: https://github.com/datamol-io/medchem/compare/2.0.4...v2.0.5-alpha

Files

datamol-io/medchem-v2.0.5-alpha.zip

Files (1.5 MB)

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md5:cfcb4df76ad9505b483ccc031c923875
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Additional details

Related works

Is supplement to
Software: https://github.com/datamol-io/medchem/tree/v2.0.5-alpha (URL)

Software

Repository URL
https://github.com/datamol-io/medchem