| ADMETlab 2.0: an integrated online platform for accurate and comprehensive predictions of ADMET properties G Xiong, Z Wu, J Yi, L Fu, Z Yang, C Hsieh, M Yin, X Zeng, C Wu, A Lu, ... Nucleic acids research 49 (W1), W5-W14, 2021 | 1153 | 2021 |
| DDInter: an online drug–drug interaction database towards improving clinical decision-making and patient safety G Xiong, Z Yang, J Yi, N Wang, L Wang, H Zhu, C Wu, A Lu, X Chen, S Liu, ... Nucleic acids research 50 (D1), D1200-D1207, 2022 | 54 | 2022 |
| Improving docking-based virtual screening ability by integrating multiple energy auxiliary terms from molecular docking scoring WL Ye, C Shen, GL Xiong, JJ Ding, AP Lu, TJ Hou, DS Cao Journal of Chemical Information and Modeling 60 (9), 4216-4230, 2020 | 44 | 2020 |
| Improving structure-based virtual screening performance via learning from scoring function components GL Xiong, WL Ye, C Shen, AP Lu, TJ Hou, DS Cao Briefings in bioinformatics 22 (3), bbaa094, 2021 | 39 | 2021 |
| Featurization strategies for protein–ligand interactions and their applications in scoring function development G Xiong, C Shen, Z Yang, D Jiang, S Liu, A Lu, X Chen, T Hou, D Cao Wiley Interdisciplinary Reviews: Computational Molecular Science 12 (2), e1567, 2022 | 32 | 2022 |
| Machine learning to predict metabolic drug interactions related to cytochrome P450 isozymes NN Wang, XG Wang, GL Xiong, ZY Yang, AP Lu, X Chen, S Liu, TJ Hou, ... Journal of Cheminformatics 14 (1), 23, 2022 | 16 | 2022 |
| Computational bioactivity fingerprint similarities to navigate the discovery of novel scaffolds GL Xiong, Y Zhao, L Liu, ZY Ma, AP Lu, Y Cheng, TJ Hou, DS Cao Journal of Medicinal Chemistry 64 (11), 7544-7554, 2021 | 16 | 2021 |
| A novel multi-layer prediction approach for sweetness evaluation based on systematic machine learning modeling ZF Yang, R Xiao, GL Xiong, QL Lin, Y Liang, WB Zeng, J Dong, D Cao Food Chemistry 372, 131249, 2022 | 13 | 2022 |
| Systematic comparison of ligand-based and structure-based virtual screening methods on poly (ADP-ribose) polymerase-1 inhibitors Y Zhao, XG Wang, ZY Ma, GL Xiong, ZJ Yang, Y Cheng, AP Lu, ZJ Huang, ... Briefings in Bioinformatics 22 (6), bbab135, 2021 | 6 | 2021 |
Dong-Sheng Cao (曹东升)Professor of Xiangya School of Pharmaceutical Science Central South University ChinaVerified email at csu.edu.cn
