Article
Elucidating the potential effects of point mutations on FGFR3 inhibitor resistance via combined molecular dynamics simulation and community network analysis.
Journal of computer-aided molecular design - 1 Jul 2023
Liu Bo, Ding Juntao, Liu Yugang, Wu Jianzhang, Wu Xiaoping, Chen Qian, Li Wulan
Abstract excerpt
FGFR3 kinase mutations are associated with a variety of malignancies, but FGFR3 mutant inhibitors have rarely been studied. Furthermore, the mechanism of pan-FGFR inhibitors resistance caused by kinase domain mutations is still unclear. In this study, we try to explain the mechanism of drug resistance to FGFR3 mutation through global analysis and local analysis based on molecular dynamics simulation, binding free...
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