中共党员
副教授、硕士生导师
无
计算机系统结构所
yuanyn@lzu.edu.cn
飞云楼409
目前主持在研项目:
国家自然科学基金面上项目1项(项目号:22373043);
国家自然科学基金面上项目1项(项目号:81973786);
主持参与完成的项目:
国家自然科学基金青年项目1项(项目号:21503101);
留学回国人员科技活动项目1项(项目号:教外司留[2015]311号);
甘肃省自然科学基金项目2项(项目号:1506RJZA223,20JR10RA613);
中央高校基本科研业务费专项资金项目3项。
发表SCI/EI论文30余篇,近5年主要SCI/EI论文:
[1] Yongna Yuan*, Yuhao Zhang, Xiangbo Meng, Zhenyu Liu, Bohan Wang, Ruidong Miao, Ruisheng Zhang, Wei Su, and Lei Liu, EDC-DTI: An end-to-end deep collaborative learning model based on multiple information for drug-target interactions prediction, Journal of Molecular Graphics and Modelling, 2023, 122, 108498-108508
[2] Yongna Yuan*; Haoqiu Yan; Zeyang Cui; Zhenyu Liu; Wei Su; Ruisheng Zhang ; Quantum chemical calculations with machine learning for multipolar electrostatics prediction in RNA: an application to pentose, Journal of Chemical Information and Modeling, 2022, 62, 4122-4133.
[3] Yongna Yuan*, Shaowei Fu, Dongxu Huo, Wei Su, Ruisheng Zhang, and Jiaxuan Wei, Multipole electrostatics for hairpin and pseudoknots in RNA: Improving the accuracy of force field potential energy function, J. Comput. Chem., 2021, 42, 1-16.
[4] Yongna Yuan*, Matthew J.L. Mills, Zhuangzhuang Zhang, Yan Ma, Chunyan Zhao, and Wei Su, A general RNA force field: comprehensive analysis of energy minima of molecular fragments of RNA, J. Mol. Model., 2021, 27, 137-153.
[5] Yongna Yuan; Xinhe Liu; Tingting Liu; Wencheng Liu; Yu Zhu; Haixia Zhang; Chunyan Zhao;Molecular dynamics exploring of atmosphere components interacting with lung surfactant phospholipid bilayers, Science of the Total Environment, 2020, 743: 140547-140554.
[6] Yongna Yuan*, Yan Ma, Dongxu Huo, Matthew J.L. Mills, Jiaxuan Wei, Wei Su, and Ruisheng Zhang*, Multipolar Description of atom-atom electrostatic interaction energies in single/double-stranded DNAs, J. Phys. Chem. B., 2020, 124, 10089-10103.
[7] Yongna Yuan*, Matthew J.L. Mills, Fuyang Li, Yuhong Du, Jiaxuan Wei, and Wei Su, Halogen bonds and other noncovalent interactions in the crystal structures of trans-1,2-diiodo alkenes: an ab initio and QTAIM study, J. Mol. Model., 2020, 26, 331-341.
[8] Yongna Yuan*,Zhuangzhuang Zhang,Matthew J.L. Mills,Rongjing Hu, and Ruisheng Zhang, Assessing force filed potential energy function accuracy via a multipolar description of atomic electrostatic interactions in RNA. J. Chem. Inf. Model. 2018, 58, 2239-2254.
[9] Xiaoliang Fan, Lei Guo, Ning Han, Yujie Wang, Jia Shi, Yongna Yuan*, A deep learning approach for next location prediction. The 2018 IEEE 22nd International Conference on Computer Supported Cooperative Work in Design, 2018.05.09-05.11.
[10] Yabing Yao, Ruisheng Zhang, Fan Yang, Yongna Yuan, and Rongjing Hu, Link prediction in complex networks based on the interactions among paths, Physica, 2018, 510, 52-67.
1. Manchester University
2.3M Corporate Research Analytical Laboratory, Saint Paul, Minnesota 55114, United States.
2013.09 -2017.06担任2013级本科生班主任
2018.09 - 2022.06 担任2018级基地班班主任
2022.09 – 至今 担任2022级基地班班主任
欢迎计算机、化学和生物学等专业,对机器学习、AI+药物设计、AI+蛋白质分子模拟感兴趣的本科生(推免生)加入,如有意愿请邮件联系。