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Ryckaert, J.P., Ciccotti, G. and Berendsen, H.V.C. (1977) Numerical Integration of Cartesian Equations of Motion of Systems with Constraints-Molecular Dynamics of N-Alkanes. Journal of Computational Physics, 23, 327-341.
https://doi.org/10.1016/0021-9991(77)90098-5

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