scholarly journals Conformational Transition Pathways of Epidermal Growth Factor Receptor Kinase Domain from Multiple Molecular Dynamics Simulations and Bayesian Clustering

2014 ◽  
Vol 10 (8) ◽  
pp. 3503-3511 ◽  
Author(s):  
Yan Li ◽  
Xiang Li ◽  
Weiya Ma ◽  
Zigang Dong
Keyword(s):  
Molecular Dynamics ◽  
Epidermal Growth Factor Receptor ◽  
Conformational Transition ◽  
Growth Factor Receptor ◽  
Kinase Domain ◽  
Bayesian Clustering ◽  
Receptor Kinase ◽  
Transition Pathways ◽  
Epidermal Growth ◽  
Dynamics Simulations

scholarly journals Effect of double mutations T790M/L858R on conformation and drug-resistant mechanism of epidermal growth factor receptor explored by molecular dynamics simulations

RSC Advances ◽  
2018 ◽  
Vol 8 (70) ◽  
pp. 39797-39810 ◽  
Author(s):  
Fangfang Yan ◽  
Xinguo Liu ◽  
Shaolong Zhang ◽  
Jing Su ◽  
Qinggang Zhang ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Free Energy ◽  
Epidermal Growth Factor Receptor ◽  
Decomposition Method ◽  
Growth Factor Receptor ◽  
Drug Resistant ◽  
Energy Decomposition ◽  
Free Energy Decomposition ◽  
Epidermal Growth ◽  
Dynamics Simulations

The MM-GBSA method coupled with residue-based free energy decomposition method was performed to explore drug-resistant mechanisms of the mutated EGFR.

scholarly journals Epidermal Growth Factor Receptor Kinase Domain Mutations in Esophageal and Pancreatic Adenocarcinomas

2006 ◽  
Vol 12 (14) ◽  
pp. 4283-4287 ◽  
Author(s):  
Eunice L. Kwak ◽  
Janusz Jankowski ◽  
Sarah P. Thayer ◽  
Gregory Y. Lauwers ◽  
Brian W. Brannigan ◽  
...  
Keyword(s):  
Epidermal Growth Factor Receptor ◽  
Growth Factor ◽  
Epidermal Growth Factor ◽  
Growth Factor Receptor ◽  
Kinase Domain ◽  
Receptor Kinase ◽  
Epidermal Growth ◽  
Kinase Domain Mutations

scholarly journals Molecular Dynamics Analysis of Binding Sites of Epidermal Growth Factor Receptor Kinase Inhibitors

ACS Omega ◽  
2020 ◽  
Vol 5 (26) ◽  
pp. 16307-16314
Author(s):  
Dong-Dong Li ◽  
Ting-Ting Wu ◽  
Pan Yu ◽  
Zhen-Zhong Wang ◽  
Wei Xiao ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Epidermal Growth Factor Receptor ◽  
Growth Factor ◽  
Epidermal Growth Factor ◽  
Binding Sites ◽  
Kinase Inhibitors ◽  
Growth Factor Receptor ◽  
Dynamics Analysis ◽  
Receptor Kinase ◽  
Epidermal Growth
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