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. Author manuscript; available in PMC: 2020 Jan 11.
Published in final edited form as: Bioorg Chem. 2019 Nov 13;94:103414. doi: 10.1016/j.bioorg.2019.103414

Fig. 15.

Fig. 15.

QTAIM calculations obtained for compounds PF-543, 10b, 11a, 11b, 16a and 16b. The blue and orange bars correspond to the rho value (Σρ(r)) for the polar and non-polar portions of each ligand, respectively.