Bulletin of the American Physical Society
APS March Meeting 2022
Volume 67, Number 3
Monday–Friday, March 14–18, 2022; Chicago
Session Y32: Material Science and Machine Learning II
8:00 AM–9:48 AM,
Friday, March 18, 2022
Room: McCormick Place W-192B
Sponsoring
Unit:
GDS
Chair: William Ratcliff, GDS
Abstract: Y32.00007 : Crystal Diffusion Variational Autoencoder for Periodic Material Generation*
9:12 AM–9:24 AM
Presenter:
Tian Xie
(Massachusetts Institute of Technology)
Authors:
Tian Xie
(Massachusetts Institute of Technology)
Xiang Fu
(Massachusetts Institute of Technology MI)
Octavian Ganea
(Massachusetts Institute of Technology)
Regina Barzilay
(Massachusetts Institute of Technology)
Tommi S Jaakkola
(Massachusetts Institute of Technology)
*The authors gratefully thank DARPA (HR00111920025) and the consortium Machine Learning for Pharmaceutical Discovery and Synthesis (mlpds.mit.edu) for support.
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