zincware / IPSuite

Machine Learned Interatomic Potential Tools
https://ipsuite.readthedocs.io
Eclipse Public License 2.0
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removed MACE and Nequip models #328

Closed M-R-Schaefer closed 3 months ago

M-R-Schaefer commented 3 months ago

The required torch versions clash / are so old that they are no longer pip installable. The nodes for the respective models have been moved to https://github.com/zincware/ips-mace https://github.com/zincware/ips-nequip

TODO: