Lili Duan

Publication Activity (10 Years)

Years Active: 2019-2024
Publications (10 Years): 14

Top Topics

Molecular Dynamics Simulations

Respiratory Syndrome Coronavirus

Top Venues

Physical chemistry chemical physics : PCCP

Cellular and molecular life sciences : CMLS

This page only lists publications with an associated author ORCID identifier.

Publications

Bolin Tang, Song Luo, Qihang Wang, Pengfei Gao, Lili Duan
Advanced molecular mechanisms of modified DRV compounds in targeting HIV-1 protease mutations and interrupting monomer dimerization. Physical chemistry chemical physics : PCCP (2024)
Bolin Tang, Song Luo, Qihang Wang, Pengfei Gao, Lili Duan
Advanced molecular mechanisms of modified DRV compounds in targeting HIV-1 protease mutations and interrupting monomer dimerization. Physical chemistry chemical physics : PCCP 26 (6) (2024)
Song Luo, Danyang Xiong, Bolin Tang, Bangyu Liu, Xiaoyu Zhao, Lili Duan
Evaluating mAbs binding abilities to Omicron subvariant RBDs: implications for selecting effective mAb therapies. Physical chemistry chemical physics : PCCP 26 (15) (2024)
Song Luo, Danyang Xiong, Bolin Tang, Bangyu Liu, Xiaoyu Zhao, Lili Duan
Evaluating mAbs binding abilities to Omicron subvariant RBDs: implications for selecting effective mAb therapies. Physical chemistry chemical physics : PCCP 26 (15) (2024)
Bolin Tang, Song Luo, Qihang Wang, Pengfei Gao, Lili Duan
Advanced molecular mechanisms of modified DRV compounds in targeting HIV-1 protease mutations and interrupting monomer dimerization. Physical chemistry chemical physics : PCCP 26 (6) (2024)
Song Luo, Danyang Xiong, Bolin Tang, Bangyu Liu, Xiaoyu Zhao, Lili Duan
Evaluating mAbs binding abilities to Omicron subvariant RBDs: implications for selecting effective mAb therapies. Physical chemistry chemical physics : PCCP (2024)
Lili Duan, Bolin Tang, Song Luo, Danyang Xiong, Qihang Wang, Xiaole Xu, John Z H Zhang
Entropy driven cooperativity effect in multi-site drug optimization targeting SARS-CoV-2 papain-like protease. Cellular and molecular life sciences : CMLS 80 (11) (2023)
Qihang Wang, Song Luo, Danyang Xiong, Xiaole Xu, Lizhi Wang, Lili Duan
Comprehensive analysis unveils altered binding kinetics of 5-/6-methylCytosine/adenine modifications in R2R3-DNA system. Physical chemistry chemical physics : PCCP (2023)
Xiaoyu Zhao, Danyang Xiong, Song Luo, Lili Duan
Origin of the tight binding mode to ACE2 triggered by multi-point mutations in the omicron variant: a dynamic insight. Physical chemistry chemical physics : PCCP 24 (15) (2022)
Danyang Xiong, Xiaoyu Zhao, Song Luo, Lili Duan
Insights from computational analysis: how does the SARS-CoV-2 Delta (B.1.617.2) variant hijack ACE2 more effectively? Physical chemistry chemical physics : PCCP 24 (15) (2022)
Xiaoyu Zhao, Danyang Xiong, Song Luo, Lili Duan
Molecular investigation of the dual inhibition mechanism for targeted P53 regulator MDM2/MDMX inhibitors. Physical chemistry chemical physics : PCCP 24 (27) (2022)
Xiaoyu Zhao, Song Luo, Kaifang Huang, Danyang Xiong, John Z H Zhang, Lili Duan
Targeting mechanism for SARS-CoV-2 in silico: interaction and key groups of TMPRSS2 toward four potential drugs. Nanoscale 13 (45) (2021)
Susu Zhong, Kaifang Huang, Song Luo, Shuheng Dong, Lili Duan
Improving the performance of the MM/PBSA and MM/GBSA methods in recognizing the native structure of the Bcl-2 family using the interaction entropy method. Physical chemistry chemical physics : PCCP 22 (7) (2020)
Zhengrong Xiao, Yalong Cong, Kaifang Huang, Susu Zhong, John Zenghui Zhang, Lili Duan
Drug-resistance mechanisms of three mutations in anaplastic lymphoma kinase against two inhibitors based on MM/PBSA combined with interaction entropy. Physical chemistry chemical physics : PCCP 21 (37) (2019)