Microsoft Research AI4Science; MIT CSAIL; Department of Materials Science and Engineering, UC Berkeley; Materials Science Division, Lawrence Berkeley National Laboratory
Xiang Fu, Tian Xie, Andrew Rosen, Tommi Jaakkola, Jake Smith
Materials design;diffusion model;metal-organic framework;carbon capture;generative model;AI for Science
MOFDiff: Coarse-grained Diffusion for Metal-Organic Framework Design