COS model of water
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The COS (charge-on-spring) models for water. The original COS model was that of Straatsma and McCammon [1].
COS/B2[edit]
[2].
COS/D2[edit]
[3].
COS/G2[edit]
[4].
COS/G3[edit]
References[edit]
- ↑ T. P. Straatsma and J. A. McCammon "Molecular Dynamics Simulations with Interaction Potentials Including Polarization Development of a Noniterative Method and Application to Water", Molecular Simulation 5 pp. 181-192 (1990)
- ↑ Haibo Yu, Tomas Hansson, and Wilfred F. van Gunsteren "Development of a simple, self-consistent polarizable model for liquid water", Journal of Chemical Physics 118 pp. 221-234 (2003)
- ↑ Stephan J. Bachmann and Wilfred F. van Gunsteren "An improved simple polarisable water model for use in biomolecular simulation", Journal of Chemical Physics 141 22D515 (2014)
- ↑ Haibo Yu and Wilfred F. van Gunsteren "Charge-on-spring polarizable water models revisited: From water clusters to liquid water to ice", Journal of Chemical Physics 121 pp. 9549-9564 (2004)
- Related reading