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q-bio.QM2019★ 4 cited
MathDL: Mathematical deep learning for D3R Grand Challenge 4
Duc Duy Nguyen, Kaifu Gao, Menglun Wang +1
We present the performances of our mathematical deep learning (MathDL) models for D3R Grand Challenge 4 (GC4). This challenge involves pose prediction, affinity ranking, and free e…
q-bio.QM2018
Divide-and-Conquer Strategy for Large-Scale Eulerian Solvent Excluded Surface
Rundong Zhao, Menglun Wang, Yiying Tong +1
Motivation: Surface generation and visualization are some of the most important tasks in biomolecular modeling and computation. Eulerian solvent excluded surface (ESES) software pr…