Jinping Lei

Prof. Dr. Jinping Lei

orcid

Research Focus & Metrics

Academic Career Length

6Years (2021-Present)

(Calculated once Scilit publication data is synced: current year − year of first publication + 1)

Representative Publications

View All Publications
21 November 2022 in Journal of Chemical Information and Modeling
Verified
Journal Article
Closed access
YTYouhai Tan
Youhai Tan
LDLingxue Dai
Lingxue Dai
WHWeifeng Huang
Weifeng Huang
YGYinfeng Guo
Yinfeng Guo
SZShuangjia Zheng
Shuangjia Zheng
YYYuedong Yang
Yuedong Yang

17 March 2021 in Science China Chemistry
Verified
Journal Article
Closed access
PDF file
MBMing Bao
Ming Bao
JCJinzhou Chen
Jinzhou Chen
CPChao Pei
Chao Pei
SZSujie Zhang
Sujie Zhang
JLJinping Lei
Jinping Lei
Xinfang XuXinfang Xu
Xinfang Xu

24 January 2024 in Journal of Chemical Information and Modeling
Verified
Journal Article
Closed access
JXJunjie Xie
Junjie Xie
SCSheng Chen
Sheng Chen
JLJinping Lei
Jinping Lei
YYYuedong Yang
Yuedong Yang

31 December 2022 in Molecules
Verified
Journal Article
Open access
PDF file
MXMingyuan Xu
Mingyuan Xu
WHWeifeng Huang
Weifeng Huang
MXMin Xu
Min Xu
JLJinping Lei
Jinping Lei
HCHongming Chen
Hongming Chen
Developing molecular generative models for directly generating 3D conformation has recently become a hot research area. Here, an autoencoder based generative model was proposed for molecular conformation generation. A unique feature of our method is that the graph information embedded relative coordinate (GIE-RC), satisfying translation and rotation invariance, was proposed as a novel way for encoding molecular three-dimensional structure. Compared with commonly used Cartesian coordinate and internal coordinate, GIE-RC is less sensitive on errors when decoding latent variables to 3D coordinates. By using this method, a complex 3D generation task can be turned into a graph node feature generation problem. Examples were shown that the GIE-RC based autoencoder model can be used for both ligand and peptide conformation generation. Additionally, this model was used as an efficient conformation sampling method to augment conformation data needed in the construction of neural network-based force field.

4 December 2024 in Journal of Chemical Information and Modeling
Verified
Journal Article
Closed access
HLHaoyang Liu
Haoyang Liu
YQYifei Qin
Yifei Qin
ZNZhangming Niu
Zhangming Niu
MXMingyuan Xu
Mingyuan Xu
JWJia-Qiang Wu
Jia-Qiang Wu
HCHongming Chen
Hongming Chen

17 June 2022 in Journal of Medicinal Chemistry
Verified
Journal Article
Closed access
SLShuhao Liu
Shuhao Liu
WDWen Ding
Wen Ding
WHWeifeng Huang
Weifeng Huang
ZZZhijing Zhang
Zhijing Zhang
YGYinfeng Guo
Yinfeng Guo
WHWenhao Hu
Wenhao Hu