Probing mutation-induced conformational transformation of the GTP/M-RAS complex through Gaussian accelerated molecular dynamics simulations.
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DOI: 10.1080/14756366.2023.2195995
Abstract: Mutations highly affect the structural flexibility of two switch domains in M-RAS considered an important target of anticancer drug design. Gaussian accelerated molecular dynamics (GaMD) simulations were applied to probe the effect of mutations P40D,… read more here.
Keywords: molecular dynamics; gaussian accelerated; accelerated molecular; gtp ras ... See more keywords