Concepedia
Biophysical Journal · 2006 · 129 citations · 53 references
Open access
Proteinlipid InteractionLipid BiophysicsBiochemistryMedicinePutative Specific InteractionsPalmitoyl-oleoyl PhosphatidylcholineLipidsLipid MovementPharmacologyAtherosclerosis
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Molecular dynamics with coupling to an external bath
Herman J. C. Berendsen, Johan P. M. Postma, Wilfred F. van Gunsteren et al. · The Journal of Chemical Physics · 1984 · 30.3K citations · Full text
Vibronic Interaction, Thermodynamic Modelling, Engineering +13
Canonical dynamics: Equilibrium phase-space distributions
William G. Hoover · Physical review. A, General physics · 1985 · 22.7K citations
Engineering, Molecular Thermodynamics, Physics +13
Polymorphic transitions in single crystals: A new molecular dynamics method
Michele Parrinello, A. Rahman · Journal of Applied Physics · 1981 · 19.5K citations
GROMACS: A message-passing parallel molecular dynamics implementation
Herman J. C. Berendsen, David van der Spoel, Rudi van Drunen · Computer Physics Communications · 1995 · 10.2K citations
Engineering, Parallel Programming, Computational Chemistry +4
A molecular dynamics method for simulations in the canonical ensemble
Shūichi Nosé · Molecular Physics · 1984 · 9.9K citations
Total Energy, Engineering, Canonical Distribution +16