The performance of non-polarizable and polarizable force-field parameter sets for ethylene glycol in molecular dynamics simulations of the pure liquid and its aqueous mixtures

Author: Geerke D. P.   van Gunsteren W. F.  

Publisher: Taylor & Francis Ltd

ISSN: 1362-3028

Source: Molecular Physics, Vol.105, Iss.13-14, 2007-07, pp. : 1861-1881

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Abstract