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Physical Chemistry Chemical Physics : PCCP|December 20, 2014
Exploring the binding mechanisms of MIF to CXCR2 using theoretical approachesLei Xu, Youyong Li, Dan Li, et al.Physical Chemistry Chemical Physics : PCCP|January 30, 2020
Combined strategies in structure-based virtual screeningZhe Wang, Huiyong Sun, Chao Shen, et al.Journal of Cheminformatics|December 29, 2017
HawkRank: a new scoring function for protein-protein docking based on weighted energy termsTing Feng, Fu Chen, Yu Kang, et al.Analytical Chemistry|September 10, 2021
TEPP-46-Based AIE Fluorescent Probe for Detection and Bioimaging of PKM2 in Living CellsDong Wang, Chunmeng Li, Ya Zhu, et al.Journal of Chemical Information and Modeling|December 1, 2015
Identification and Preliminary SAR Analysis of Novel Type-I Inhibitors of TIE-2 via Structure-Based Virtual Screening and Biological Evaluation in in vitro ModelsPeichen Pan, Sheng Tian, Huiyong Sun, et al.Structural Dynamics (Melville, N.Y.)|March 15, 2019
The impact of interior dielectric constant and entropic change on HIV-1 complex binding free energy predictionYuchen Li, Yalong Cong, Guoqiang Feng, et al.Current Drug Targets|January 14, 2016
Recent Advances in Protein-Protein DockingQian Zhang, Ting Feng, Lei Xu, et al.Physical Chemistry Chemical Physics : PCCP|April 26, 2016
Comprehensive evaluation of ten docking programs on a diverse set of protein-ligand complexes: the prediction accuracy of sampling power and scoring powerZhe Wang, Huiyong Sun, Xiaojun Yao, et al.Chemical Reviews|June 28, 2019
End-Point Binding Free Energy Calculation with MM/PBSA and MM/GBSA: Strategies and Applications in Drug DesignErcheng Wang, Huiyong Sun, Junmei Wang, et al.Journal of Chemical Information and Modeling|March 17, 2020
Development and Evaluation of MM/GBSA Based on a Variable Dielectric GB Model for Predicting Protein-Ligand Binding AffinitiesErcheng Wang, Hui Liu, Junmei Wang, et al.Pageof 11