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Will the next version of SchNetPack include SpookyNet?

Open Sangwon91 opened this issue 3 years ago • 1 comments

I wonder if you have any plans to implement spookynet on the schnetpack interface. It would be great if I could use spookynet with the elegant interface of schnetpack.

Thank you.

Sangwon91 avatar Sep 30 '21 06:09 Sangwon91

Not at first, but we aim to include it at some point.

ktschuett avatar Oct 05 '21 09:10 ktschuett

Due to time constraints, we did not implement SpookyNet for our SchNetPack 2.0 release and do not plan to do so in the near future. We will close this issue for now but if there is more demand, please feel free to re-open it.

NiklasGebauer avatar Mar 24 '23 17:03 NiklasGebauer