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. Author manuscript; available in PMC: 2022 Jul 5.
Published in final edited form as: Phys Chem Chem Phys. 2017 Feb 1;19(5):4030–4040. doi: 10.1039/c6cp07564a

Fig. 4.

Fig. 4

Distribution of the hydrogen bond compression coordinate (N–O distance) and of the PT coordinate for the proton that spends most of its time on the N terminus (left) or on the C terminus (right).