MoVAE: A Variational AutoEncoder for Molecular Graph Generation

Zerun Lin, Yuhan Zhang, Lixin Duan, Le Ou-Yang, Peilin Zhao. MoVAE: A Variational AutoEncoder for Molecular Graph Generation. In Shashi Shekhar, Zhi-Hua Zhou, Yao-Yi Chiang, Gregor Stiglic, editors, Proceedings of the 2023 SIAM International Conference on Data Mining, SDM 2023, Minneapolis-St. Paul Twin Cities, MN, USA, April 27-29, 2023. pages 514-522, SIAM, 2023. [doi]

Abstract

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