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MolEdit Public Release v0.2.0

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@issacAzazel issacAzazel released this 18 May 01:45
· 2 commits to main since this release
v0.2.0
242bcc8

Source code and model weights release of MolEdit from paper: In-silico 3D Molecular Editing through Physics-Informed and Peference-Aligned Generative Foundation Models. An early version is preprinted at doi:10.26434/chemrxiv-2023-j2n6l-v2.

  • Update checkpoints and example usage notebooks of the MolEdit model trained with QMugs dataset.
  • Add training scripts
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