Pipeline of Moltemplate, PACKMOL, and bash scripts to arrange and solvate azobenzene stars in SPC/E water for MD simulations in the DREIDING model
Needs an installation of Moltemplate, Packmol, VMD and Python
Make your changes to box size, arragment of azobenzene stars etc. in the scripts. Then start the script via bash Create_Solvate.sh.