Wang, Menglun

A topology-based network tree for the prediction of protein–protein binding affinity changes following mutation

Wang, M., Cang, Z., & Wei, G.-W. (2020) · Nature Machine Intelligence

Machine Learning in BioinformaticsTopological and Geometric Data Analysis

Cited by 202

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

Rigidity Strengthening: A Mechanism for Protein–Ligand Binding

Nguyen, D. D., Xiao, T., Wang, M., & Wei, G.-W. (2017) · Journal of Chemical Information and Modeling

Computational Drug Discovery MethodsProtein Structure and Dynamics

Cited by 105