From: Alex Saad-Falcon (
Date: Mon May 21 2018 - 13:05:32 CDT

Hello all,

I am currently trying to parameterize the ligand for the protein here: just results in parameters that cause the ligand to explode
when run in namd.

I do not have Gaussian, and my university is on their ban list. If someone
could do the parameterization for me, I would be very grateful. It should
not take too long since it is just a single ligand.

I can send you the pdb files for just the ligand if you ask. Thanks in