Python Protein MD Setup tutorial
Protein MD Setup tutorial using BioExcel Building Blocks (biobb)
Based on the official GROMACS tutorial.
This tutorial aims to illustrate the process of setting up a simulation system containing a protein, step by step, using the BioExcel Building Blocks library (biobb). The particular example used is the Lysozyme protein (PDB code 1AKI).
Copyright & Licensing
Licensed under the Apache License 2.0, see the file LICENSE for details.
Created: 14th Mar 2022 at 10:06
Last updated: 14th Apr 2023 at 08:48