Code that produces bonded-parameters for CG models from atomistic trajectories. We recommend using the MARTINI force-field particle types.
Link to code: https://github.com/jag1g13/pycgtool
Link to documentation: https://pycgtool.readthedocs.io/en/master/
Please do contact us via the Github page for requests/additions/comments. We intend to keep developing the code so your input is very welcome!
Code developed by James Graham.