Wu, Kedi

Quantitative Toxicity Prediction Using Topology Based Multitask Deep Neural Networks

Wu, K., & Wei, G.-W. (2018) · Journal of Chemical Information and Modeling

Computational Drug Discovery MethodsTopological and Geometric Data Analysis

Cited by 160

Mathematical deep learning for pose and binding affinity prediction and ranking in D3R Grand Challenges

Nguyen, D. D., Cang, Z., Wu, K., Wang, M., Cao, Y., & Wei, G.-W. (2019) · Journal of Computer-Aided Molecular Design

Computational Drug Discovery MethodsMachine Learning in Materials Science

Cited by 155

A topological approach for protein classification

Cang, Z., Mu, L., Wu, K., Opron, K., Xia, K., & Wei, G.-W. (2015) · Computational and Mathematical Biophysics

Topological and Geometric Data AnalysisMachine Learning in Bioinformatics

Cited by 93