198 citations · 1.3k across the 62 of their papers we have counts for
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q-bio.BM2023★ 5 cited
Coarse-to-Fine: a Hierarchical Diffusion Model for Molecule Generation in 3D
Bo Qiang, Yuxuan Song, Minkai Xu +5
Generating desirable molecular structures in 3D is a fundamental problem for drug discovery. Despite the considerable progress we have achieved, existing methods usually generate m…
q-bio.BM2022★ 7 cited
PEMP: Leveraging Physics Properties to Enhance Molecular Property Prediction
Yuancheng Sun, Yimeng Chen, Weizhi Ma +5
Molecular property prediction is essential for drug discovery. In recent years, deep learning methods have been introduced to this area and achieved state-of-the-art performances.…