Fengjiao Liu

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 7

Top Topics

Molecular Dynamics Simulations

Crystal Structure

Top Venues

Physical chemistry chemical physics : PCCP

The Journal of organic chemistry

Journal of the American Chemical Society

Molecules (Basel, Switzerland)

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

Publications

Shipeng Wang, Fengjiao Liu, Pengfei Li, Jia-Ning Wang, Yan Mo, Bin Lin, Ye Mei
Potent inhibitors targeting cyclin-dependent kinase 9 discovered via virtual high-throughput screening and absolute binding free energy calculations. Physical chemistry chemical physics : PCCP 26 (6) (2024)
Shipeng Wang, Fengjiao Liu, Pengfei Li, Jia-Ning Wang, Yan Mo, Bin Lin, Ye Mei
Potent inhibitors targeting cyclin-dependent kinase 9 discovered via virtual high-throughput screening and absolute binding free energy calculations. Physical chemistry chemical physics : PCCP (2024)
Shipeng Wang, Fengjiao Liu, Pengfei Li, Jia-Ning Wang, Yan Mo, Bin Lin, Ye Mei
Potent inhibitors targeting cyclin-dependent kinase 9 discovered via virtual high-throughput screening and absolute binding free energy calculations. Physical chemistry chemical physics : PCCP 26 (6) (2024)
Yi Sun, Fengjiao Liu, Jacob N Sanders, Kendall N Houk
Role of Steric Effects on Rates of Hydrogen Atom Transfer Reactions. The Journal of organic chemistry (2023)
Siqi Ma, Shipeng Wang, Jiawei Cao, Fengjiao Liu
Rapid and Accurate Estimation of Activation Free Energy in Hydrogen Atom Transfer-Based C-H Activation Reactions: From Empirical Model to Artificial Neural Networks. ACS omega 7 (39) (2022)
Fengjiao Liu, Siqi Ma, Zeying Lu, Anjanay Nangia, Meng Duan, Yanmin Yu, Guochao Xu, Ye Mei, Massimo Bietti, Kendall N Houk
Hydrogen Abstraction by Alkoxyl Radicals: Computational Studies of Thermodynamic and Polarity Effects on Reactivities and Selectivities. Journal of the American Chemical Society 144 (15) (2022)
Pengfei Li, Fengjiao Liu, Xiangyu Jia, Yihan Shao, Wenxin Hu, Jun Zheng, Ye Mei
Efficient Computation of Free Energy Surfaces of Diels⁻Alder Reactions in Explicit Solvent at Ab Initio QM/MM Level. Molecules (Basel, Switzerland) 23 (10) (2018)