Pyrx [1] is a virtual screening software that allows the docking of multiple ligands with a target protein. Previously, we provided an article on the installation of Pyrx in Ubuntu. In this article, we are going to perform protein-ligand docking using Pyrx. ContentsDownloading ProteinDownloading ligandPreparing the proteinPreparing the ligandPerforming docking using PyrxLoading protein and ligandDefining … Continue reading How to perform site-specific docking using Pyrx?