| Molecular convolutional neural networks with DNA regulatory circuits X Xiong, T Zhu, Y Zhu, M Cao, J Xiao, L Li, F Wang, C Fan, H Pei Nature Machine Intelligence 4 (7), 625-635, 2022 | 89 | 2022 |
| Bridge‐Caging Strategy in Phosphorus‐Substituted Rhodamine for Modular Development of Near‐Infrared Fluorescent Probes X Chai, J Xiao, M Li, C Wang, H An, C Li, Y Li, D Zhang, X Cui, T Wang Chemistry–A European Journal 24 (54), 14506-14512, 2018 | 35 | 2018 |
| A machine learning-based high-precision density functional method for drug-like molecules J Xiao, YX Chen, LF Zhang, H Wang, T Zhu Artificial Intelligence Chemistry 2 (1), 100037, 2024 | 3 | 2024 |
| Deep Learning-Based construction of a Drug-Like compound database and its application in virtual screening of HsDHODH inhibitors W Xia, J Xiao, H Bian, J Zhang, JZH Zhang, H Zhang Methods 225, 44-51, 2024 | 2 | 2024 |
| Machine Learning Based Density Functional Method for Chemical Reactions I: Organic Reactions J Xiao, Y Zhang, B Li, H Wang, JZH Zhang, T Zhu | | 2024 |
| The atomic density based tight-binding (aTB) model: A robust and accurate semi-empirical method parameterized for H-Ra; applied to structures, vibrational frequencies … Y Zhang, J Xiao, S Wang, T Zhu, JZH Zhang | | 2024 |
| Transition State Searching Accelerated by Deep Learning Potential B Li, J Xiao, Y Gao, J Zhang, T Zhu | | 2024 |
| Small-Molecule Inhibitors of TIPE3 Protein Identified through Deep Learning Suppress Cancer Cell Growth In Vitro X Chen, Z Lu, J Xiao, W Xia, Y Pan, H Xia, YH Chen, H Zhang Cells 13 (9), 771, 2024 | | 2024 |
Tong Zhu (朱通)Professor, East China Normal UniversityVerified email at lps.ecnu.edu.cn