The impact of charges in force field parameterization for molecular dynamics simulations of deep eutectic solvents

Title
The impact of charges in force field parameterization for molecular dynamics simulations of deep eutectic solvents
Authors
Keywords
Deep eutectic solvents, Molecular dynamics, Force field parameterization, Atomic charges
Journal
JOURNAL OF MOLECULAR LIQUIDS
Volume 211, Issue -, Pages 506-514
Publisher
Elsevier BV
Online
2015-08-07
DOI
10.1016/j.molliq.2015.07.070

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