Enlighten2

Molecular Dynamics Simulations of Protein-Ligand Systems Made Accessible. Protocols and tools to run (automated) atomistic simulations of enzyme-ligand systems. To acknowledge the use of the Enlighten2 plugin and/or protocols, please cite the following publication:. Download PyMOL plugin PyMOL plugin GitHub page Python package GitHub page. Enlighten2 allows to easily prepare and run molecular dynamics simulations of protein-ligand systems. It requires no installation or knowledge of computational chemistry software and can be run on any machine (Windows, Mac or Linux) that has PyMOL and Docker installed. It consists of three main parts:.