Ying Xue

Mechanistic Insight into Hydrogen-Bond-Controlled Crystallinity and Adsorption Property of Covalent Organic Frameworks from Flexible Building Blocks

Xinghua Guo, Tian Yin, Meicheng Zhang et al. · Chemistry of Materials · 2018 · 289 citations

Effect of Selection of Molecular Descriptors on the Prediction of Blood−Brain Barrier Penetrating and Nonpenetrating Agents by Statistical Learning Methods

Hu Li, Chun Wei Yap, Choong Yong Ung et al. · Journal of Chemical Information and Modeling · 2005 · 163 citations

Prediction of P-Glycoprotein Substrates by a Support Vector Machine Approach

Ying Xue, Chun Wei Yap, Lin Sun et al. · Journal of Chemical Information and Computer Sciences · 2004 · 159 citations

Drug Target, Glycobiology, Svm System +22

Effect of Molecular Descriptor Feature Selection in Support Vector Machine Classification of Pharmacokinetic and Toxicological Properties of Chemical Agents

Ying Xue, Zirui Li, Chun Wei Yap et al. · Journal of Chemical Information and Computer Sciences · 2004 · 156 citations

Engineering, Machine Learning, Statistical-learning Methods +23

Molecular simulation of CH4, CO2, H2O and N2 molecules adsorption on heterogeneous surface models of coal

Xiaoqiang Liu, Xu He, Nianxiang Qiu et al. · Applied Surface Science · 2016 · 155 citations

Carbon Sequestration, Chemical Engineering, N2 Molecules Adsorption +11