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Use with MACE-OFF #3

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tlhr opened this issue Sep 10, 2024 · 0 comments
Open

Use with MACE-OFF #3

tlhr opened this issue Sep 10, 2024 · 0 comments

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@tlhr
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tlhr commented Sep 10, 2024

Thanks for this very neat piece of work and the clean code! I would love to play with this for protein-ligand systems and was wondering how to swap out the MACE-MP force field with MACE-OFF, and if that's even possible. Are there differences in the architectures that would complicate this? Thanks a lot!

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