Numerical Integration of the Cartesian Equations of Motion of a System with Constraints: Molecular Dynamics of n-Alkanes
Numerical Integration of the Cartesian Equations of Motion of a System with Constraints: Molecular Dynamics of n-Alkanes
J. Ryckaert,G. Ciccotti,H. Berendsen
1977 · DOI: 10.1016/0021-9991(77)90098-5
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