Electrostatics studies and molecular dynamics simulations of a homology model of theShakerK+channel pore
β Scribed by Kishani M. Ranatunga; Richard J. Law; Graham R. Smith; Mark S.P. Sansom
- Publisher
- Springer
- Year
- 2001
- Tongue
- English
- Weight
- 251 KB
- Volume
- 30
- Category
- Article
- ISSN
- 1432-1017
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Nanosecond molecular dynamics simulations in a fully solvated phospholipid bilayer have been performed on single transmembrane β£-helices from three putative ion channel proteins encoded by viruses: NB (from influenza B), CM2 (from influenza C), and Vpu (from HIV-1). β£-Helix stability is maintained w
## Abstract Molecular dynamics (MD) simulations of several nanoseconds each were used to monitor the dynamic behavior of the five crystal water molecules buried in the interior of the Nβterminal domain of apolipoprotein E. These crystal water molecules are fairly well conserved in several apolipopr