Hi, I'm a recent user of PyRosetta and because of this I'm having some problems with it. I'm trying to dock some peptides in a metalloprotease, and I want to keep the zinc in the active site.
I tried to use the script "molfile_to_params.py" as it's in the manual, but the script can't find the libraries.
>>>Traceback (most recent call last):
>>> File "./molfile_to_params.py", line 25, in
>>> from rosetta_py.io.mdl_molfile import *
>>>ImportError: No module named rosetta_py.io.mdl_molfile
I searched for similar libraries, but I didn't find them.
Could I solve this? Is there another method to load the zinc?
José Geraldo de Carvalho Pereira
Master Student of Molecular Biology - Bioinformatics
University of Campinas, Brazil