Start a module for training surrogates

globus-labs / cascade

Fast and reliable dynamic simulations by concurrently learning, auditing, and using surrogates

MIT License

1 stars 0 forks source link

Closed WardLT closed 5 months ago

WardLT commented 5 months ago

Make the components needed to train a

Fixes #13 by adding TorchANI support, which is >10x faster than MACE

Works towards #15