4. Xiao-Qiang Liu, Ying Xue, Zhi-Yue Tian, Jing-Jing Mo, Nian-Xiang Qiu, Wei Chu, He-Ping Xie, “Adsorption of CH4 on nitrogen- and boron-containing carbon models of coal predicted by density-functional theory”, Applied Surface Science, 2013, 285P, 190– 197.
5. Bing-ke Li, Yong Cong, Zhi-yue Tian, Ying Xue, “Predicting and Virtually Screening the Selective Inhibitors of MMP-13 over MMP-1 by Molecular Descriptors and Machine Learning Methods”, Acta Phys.-Chim. Sin., 2014, 30 (1), 171-182.
6. Nian-xiang Qiu, Zhi-yue Tian, Yong Guo, Cheng-hua Zhang, Yan-ping Luo, Ying Xue, “A first-principle study of calcium-decorated BC2N sheet doped by boron or carbon for high hydrogen storage”, International Journal of Hydrogen Energy, 2014, 39(17), 9307-9320.
7. Lin-Lin Fan, Xin Yang, Zhi-Yue Tian, Xue-Kun Zhao, Rui-Xiang Li, Ying Xue, “Theoretical calculation of the pKa values of 1-aryl-4-propylpiperzaine in aqueous solution”, Chemical Research in Chinese Universities, 2014, 30(3), 455-460.