e3nnfor the Scientific Machine Learning Mini-Course hosted by CMU, November 5, 2020.
e3nnfor the Machine learning in Physics, Chemistry and Materials discussion group (MLDG) at the University of Cambridge, November 9, 2020.
This tutorial uses a combination of slides and interactive jupyter notebooks using the
e3nn framework to present fundamental concepts about Euclidean equivariant neural networks: data types, equivariant operations, how symmetry effects simple tasks, and how to construct the building blocks of
e3nn. This tutorial was originally presented at IPAM at UCLA on November 14, 2019.
Convolutional neural networks for point clouds and voxels with Euclidean symmetries (3D translation and 3D rotation). The current code is a merger of the work from Tensor field networks and 3D Steerable CNNs.
Zhantao Chen, Nina Andrejevic, Tess Smidt, Zhiwei Ding, Yen-Ting Chi, Quynh T. Nguyen, Ahmet Alatas, Jing Kong, Mingda Li, arXiv (2020). arXiv:2009.05163
Tess E. Smidt, ChemRxiv (2020). DOI:10.26434/chemrxiv.12935198
Benjamin Kurt Miller, Mario Geiger, Tess E. Smidt, Frank Noé, arXiv (2020). arXiv:2008.08461
Maserati, L. et al, Materials Horizons (2020). DOI:10.1039/C9MH01917K
Smidt, T.E., Mack, S.A., Reyes-Lillo, S.E. et al. Sci Data 7, 72 (2020).
figshare data deposit