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. Author manuscript; available in PMC: 2018 Feb 27.
Published in final edited form as: J Chem Theory Comput. 2017 May 26;13(6):2501–2510. doi: 10.1021/acs.jctc.7b00204

Figure 5.

Figure 5

(A) λ trajectories for simulations with T4 lysozyme using pairwise GSLD for the χ* = −180° (top) and χ* = −60° (bottom); (B) Free energy estimation using RBE for χ* = −180° (top) and χ* = −60° (bottom).