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. Author manuscript; available in PMC: 2020 Sep 10.
Published in final edited form as: J Chem Theory Comput. 2019 Aug 29;15(9):4982–5000. doi: 10.1021/acs.jctc.9b00327

Figure 14.

Figure 14.

Boltzmann-inverted probability distribution of β (1→4)-glycosidic linkage (ϕ = O5(N)-C1(N)-O4(U)–C4(U) and ψ = C1(N)-O4(U)–C4(U)-C5(U)) in unsulfated chondroitin (CN6) is shown for additive (a and b) and Drude (c and d) simulations, respectively.