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. Author manuscript; available in PMC: 2014 Jan 10.
Published in final edited form as: J Phys Chem B. 2012 Dec 24;117(1):94–103. doi: 10.1021/jp3084277

Figure 4.

Figure 4

Free energy profiles for reaction model 4 (inset) with different force field models in the presence of sodium chloride. The experimental value is given for a UpG dinucleotide (Ref. 25, 310 K and ionic strength of 1 M in NaOH/NaCl, dashed line). In order to aid visual comparison of barrier heights, the plots are shifted such that FR) = 0.0. Filled curves represent estimated 95% confidence intervals relative to the appropriate reactant state.