SAKE implementation - Githubissues

choderalab / modelforge

Infrastructure to implement and train NNPs

https://modelforge.readthedocs.io/en/latest/

MIT License

12 stars 5 forks source link

SAKE implementation #50

Closed ArnNag closed 10 months ago

ArnNag commented 10 months ago

Description

Implement the SAKE architecture for modelforge

Todos

[ ] Fix the implementation to work with the model API
[ ] Run equivariance tests

Status

[ ] Ready to go