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. Author manuscript; available in PMC: 2022 Jun 28.
Published in final edited form as: J Chem Inf Model. 2021 Jun 7;61(6):2806–2817. doi: 10.1021/acs.jcim.1c00426

Figure 1:

Figure 1:

Examples of structures used in AMOEBA+ energy calculations. Blue and purple spheres represent cation and anion, respectively; red/white spheres represent O/H in water.