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"Machine learning-aided generative molecular design."
Yuanqi Du et al. (2024)
- Yuanqi Du, Arian R. Jamasb, Jeff Guo, Tianfan Fu, Charles Harris, Yingheng Wang, Chenru Duan, Pietro Liò, Philippe Schwaller, Tom L. Blundell:
Machine learning-aided generative molecular design. Nat. Mac. Intell. 6(6): 589-604 (2024)
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