This combines our best invariant model with some comparatively "light" equivariance (meaning it has equivariance without huge architectural or computational cost). It should serve as a bridge from our models to the CG-tensor product and Spherical Harmonics models.
A hydrid PNA / PAINN model.
This combines our best invariant model with some comparatively "light" equivariance (meaning it has equivariance without huge architectural or computational cost). It should serve as a bridge from our models to the CG-tensor product and Spherical Harmonics models.