The chemical structure of the phyto-ligands was retrieved from the PubChem database which is available at NCBI (http://www.pubchem.ncbi.nlm.nih.gov). The 2D conformations of the phyto-ligands were downloaded in SDF format and converted into PDB format. The structural optimization was performed using Discovery Studio visualizer. Thus obtained chemical structures were used for further docking analysis (Yadav et al., 2017).

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