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. Author manuscript; available in PMC: 2016 Oct 13.
Published in final edited form as: J Chem Theory Comput. 2015 Sep 17;11(10):4770–4779. doi: 10.1021/acs.jctc.5b00662

Figure 5.

Figure 5

Tendencies for helical (>0) or extended conformations (<0) for each amino acid in different peptides. Different force field's tendencies are shown, as well as the experimental structure for comparison (see table 1). Orange: ff12SB, blue: ff12SB-CMAP. Error bars correspond to one standard deviation as calculated from dividing the trajectory in 5 blocks.

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