82 citations · 220 across the 7 of their papers we have counts for
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cs.LG2022★ 79 cited
Pocket2Mol: Efficient Molecular Sampling Based on 3D Protein Pockets
Xingang Peng, Shitong Luo, Jiaqi Guan +3
Deep generative models have achieved tremendous success in designing novel drug molecules in recent years. A new thread of works have shown the great potential in advancing the spe…
q-bio.BM2022★ 4 cited
Orientation-Aware Graph Neural Networks for Protein Structure Representation Learning
Jiahan Li, Shitong Luo, Congyue Deng +5
By folding into particular 3D structures, proteins play a key role in living beings. To learn meaningful representation from a protein structure for downstream tasks, not only the…