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. Author manuscript; available in PMC: 2011 Mar 4.
Published in final edited form as: J Phys Chem B. 2010 Mar 4;114(8):2901–2909. doi: 10.1021/jp906791b

Figure 3.

Figure 3

Single ion PMFs from BD simulations (solid lines) for (a) (M113N)7, (b) (M113N)7·βCD, and (c) (M113N)7·βCD with all charges on the βCD atoms set to zero Free energy profiles of a single K+ or Cl− located along the channel axis calculated via Eq. (2) are shown as dashed lines. See Figure 2 for further information.