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v0.5.6

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@Linux-cpp-lisp Linux-cpp-lisp released this 20 Dec 18:52
· 209 commits to main since this release
dceaf49

[0.5.6] - 2022-12-19

Added

  • sklearn dependency removed
  • nequip-benchmark and nequip-train report number of weights and number of trainable weights
  • nequip-benchmark --no-compile and --verbose and --memory-summary
  • nequip-benchmark --pdb for debugging model (builder) errors
  • More information in nequip-deploy info

Changed

  • Minimum e3nn is now 0.4.4
  • --equivariance-test now prints much more information, especially when there is a failure

Fixed

  • Git utilities when installed as ZIPed .egg (#264)