Generating 3D Molecules for Target Protein Binding

Meng Liu, Youzhi Luo, Kanji Uchino, Koji Maruhashi, Shuiwang Ji. Generating 3D Molecules for Target Protein Binding. 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 13912-13924, PMLR, 2022. [doi]

Abstract

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