195 citations · 551 across the 15 of their papers we have counts for
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cs.LG2024★ 13 cited
Generative Artificial Intelligence for Navigating Synthesizable Chemical Space
Wenhao Gao, Shitong Luo, Connor W. Coley
We introduce SynFormer, a generative modeling framework designed to efficiently explore and navigate synthesizable chemical space. Unlike traditional molecular generation approache…
cs.CE2024★ 7 cited
Projecting Molecules into Synthesizable Chemical Spaces
Shitong Luo, Wenhao Gao, Zuofan Wu +3
Discovering new drug molecules is a pivotal yet challenging process due to the near-infinitely large chemical space and notorious demands on time and resources. Numerous generative…