95 citations · 252 across the 15 of their papers we have counts for
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cs.LG2022★ 23 cited
Generative Coarse-Graining of Molecular Conformations
Wujie Wang, Minkai Xu, Chen Cai +5
Coarse-graining (CG) of molecular simulations simplifies the particle representation by grouping selected atoms into pseudo-beads and drastically accelerates simulation. However, s…
cs.LG2022★ 1 cited
Convergence of Invariant Graph Networks
Chen Cai, Yusu Wang
Although theoretical properties such as expressive power and over-smoothing of graph neural networks (GNN) have been extensively studied recently, its convergence property is a rel…