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BFEE-Docking v1.0.5

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@fhh2626 fhh2626 released this 29 Sep 06:02

What's changed

  • Updated the bundled CHARMM General Force Field (CGenFF) parameter file from version 4.6 to version 5.0.
  • Bumped the BFEE-Docking package version to 1.0.5.

Installation

After PyPI publication, install with pip install bfee-docking==1.0.5.

Full changelog: v1.0.4...v1.0.5