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. 2016 Jun 3;144(21):214105. doi: 10.1063/1.4953037

FIG. 6.

FIG. 6.

Pair distance distribution function (PDDF) of water-solute for lysozyme (left) and myoglobin (right). The PDDFs are computed by Fourier-transforming (using IFT) the cross-term F˜soluqF˜hydq for experimental data (black, taken from Ref. 26), MD (orange), and 3D-RISM.