A Suite of Advanced Tutorials for the GROMOS Biomolecular Simulation Software

This repository contains a collection of files accompanying the suite of GROMOS tutorials described in a LiveCoMS publication. The final pdf version of the manuscript can be found in the releases directory. The corresponding source files are located in published_MS. Each subdirectory in the directory tutorial_files contains all files necessary for completing each of the three tutorials described in the manuscript. The tutorials are designed for users with some experience in the application of molecular dynamics simulations. Therefore, we suggest to carry out the basic tutorial first, that is available on www.gromos.net after registration. The GROMOS version required for carrying out the advanced tutorials was released on January 09, 2021.