Path-Aware and Structure-Preserving Generation of Synthetically Accessible Molecules

Juhwan Noh, Dae-Woong Jeong, Kiyoung Kim, Sehui Han, Moontae Lee, Honglak Lee, Yousung Jung. Path-Aware and Structure-Preserving Generation of Synthetically Accessible Molecules. In Kamalika Chaudhuri, Stefanie Jegelka, Le Song, Csaba Szepesvári, Gang Niu 0001, Sivan Sabato, editors, International Conference on Machine Learning, ICML 2022, 17-23 July 2022, Baltimore, Maryland, USA. Volume 162 of Proceedings of Machine Learning Research, pages 16952-16968, PMLR, 2022. [doi]

Abstract

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