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. Author manuscript; available in PMC: 2015 Jul 1.
Published in final edited form as: Proteins. 2014 Jan 25;82(7):1387–1399. doi: 10.1002/prot.24506

Figure 7.

Figure 7

Thermodynamic cycle for the mutation of the R-enantiomer into the S-enantiomer. Here, the mutation of CH3 to H and H to CH3 is described schematically. As outlined in the main text, the mutation is practically done at the transition state by converting both, the CH3 and H, to dummy atoms.