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. Author manuscript; available in PMC: 2014 Aug 13.
Published in final edited form as: J Chem Theory Comput. 2013 Jun 25;9(8):3769–3788. doi: 10.1021/ct400230y

Figure 18.

Figure 18

Simulated vs experimental helicities as a function of residue for (AAQAA)3 with PRIMO/C22 (green, triangles), PRIMO/C36 (blue, circles), and from experiment (red, squares) at 270 K71.