5 citations · 5 across the 3 of their papers we have counts for
3 papers
q-bio.QM2017★ 5 cited
TopP-S: Persistent homology based multi-task deep neural networks for simultaneous predictions of partition coefficient and aqueous solubility
Kedi Wu, Zhixiong Zhao, Renxiao Wang +1
Aqueous solubility and partition coefficient are important physical properties of small molecules. Accurate theoretical prediction of aqueous solubility and partition coefficient p…
q-bio.QM2017
Feature functional theory - binding predictor (FFT-BP) for the blind prediction of binding free energies
Bao Wang, Zhixiong Zhao, Duc D. Nguyen +1
We present a feature functional theory - binding predictor (FFT-BP) for the protein-ligand binding affinity prediction. The underpinning assumptions of FFT-BP are as follows: i) re…
q-bio.BM2015
Multiresolution topological simplification
Kelin Xia, Zhixiong Zhao, Guo-Wei Wei
Persistent homology has been devised as a promising tool for the topological simplification of complex data. However, it is computationally intractable for large data sets. In this…