Research Article

Computational Elucidation of Structural Basis for Ligand Binding with Leishmania donovani Adenosine Kinase

Figure 8

Van der waals and π-stacking interactions between halide atoms from organic molecule. (a) Structures from docking studies of all ligands with the nearby amino acid residues. (b) Structures from MD snapshots.
609289.fig.008a
(a)
609289.fig.008b
(b)