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. 2014 Apr 15;9(4):e95024. doi: 10.1371/journal.pone.0095024

Table 3. Calculated binding affinities using MolDock for enkephalin and its derivatives with ASGPR.

Compound MolDock Score# (kcal/mol)
Enkephalin Positive
Gal-Enk Positive
Lac-Enk Positive
Gal-Lac-Enk −9
D-Galactose −34
D-Lactose −45
#

The binding affinity was calculated by energy minimization and given a MolDock score, which was derived from the piecewise linear potential scoring function [53].