Ge Yunhui

An overview of the SAMPL8 host–guest binding challenge

Martin Amezcua, Jeffry Setiadi, Ge Yunhui et al. · Journal of Computer-Aided Molecular Design · 2022 · 63 citations · Full text

Pharmacy, Biophysics, Medicinal Chemistry +17

Temperature artifacts in protein structures bias ligand-binding predictions

S.Y.C. Bradford, Léa El Khoury, Ge Yunhui et al. · Chemical Science · 2021 · 49 citations · Full text

Life Sciences, Biochemistry, Biophysics +17

Reconciling Simulated Ensembles of Apomyoglobin with Experimental Hydrogen/Deuterium Exchange Data Using Bayesian Inference and Multiensemble Markov State Models

Hongbin Wan, Ge Yunhui, Asghar M. Razavi et al. · Journal of Chemical Theory and Computation · 2020 · 46 citations

Natural Sciences, Biochemistry, Biophysics +17

Prioritizing Small Sets of Molecules for Synthesis through <i>in‐silico</i> Tools: A Comparison of Common Ranking Methods

Marko Breznik, Ge Yunhui, Joseph P. Bluck et al. · ChemMedChem · 2022 · 43 citations · Full text

Pharmacy, Chemistry, Medicinal Chemistry +17

Structural insights into telomere protection and homeostasis regulation by yeast CST complex

Ge Yunhui, Zhenfang Wu, Hongwen Chen et al. · Nature Structural & Molecular Biology · 2020 · 42 citations

Life Sciences, Genetics, Molecular Biology +16