Binding Mode Investigation of Polyphenols from <i>Scrophularia</i> Targeting Human Aldose Reductase Using Molecular Docking and Molecular Dynamics Simulations

<div>Superimposed view of docked pose (red) of the ALR2 inhibitor (tolrestat) with the crystal structure conformation (green) (RMSD = 0.53200 Å).</div>

Journal of Chemistry

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Figure 1

Figure 1: Binding Mode Investigation of Polyphenols from <i>Scrophularia</i> Targeting Human Aldose Reductase Using Molecular Docking and Molecular Dynamics Simulations 

Figure 1 | Binding Mode Investigation of Polyphenols from Scrophularia Targeting Human Aldose Reductase Using Molecular Docking and Molecular Dynamics Simulations 