8 citations · 18 across the 6 of their papers we have counts for
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cs.LG2022★ 6 cited
Predicting Cellular Responses with Variational Causal Inference and Refined Relational Information
Yulun Wu, Robert A. Barton, Zichen Wang +5
Predicting the responses of a cell under perturbations may bring important benefits to drug discovery and personalized therapeutics. In this work, we propose a novel graph variatio…
cs.LG2021★ 8 cited
Spatial Graph Attention and Curiosity-driven Policy for Antiviral Drug Discovery
Yulun Wu, Mikaela Cashman, Nicholas Choma +13
We developed Distilled Graph Attention Policy Network (DGAPN), a reinforcement learning model to generate novel graph-structured chemical representations that optimize user-defined…