Phosphotyrosine Parameters/Toplogy

From: Alex Saad-Falcon (alexsaadfalcon_at_gmail.com)
Date: Fri Jan 25 2019 - 12:10:14 CST

What is the proper way to create a new residue for PTR (phosphotyrosine) as
seen in the 2HDX pdb? It is easy enough to simply add bonds, but is there a
way to run QM on just the new residue?

This archive was generated by hypermail 2.1.6 : Sun Sep 15 2019 - 23:20:14 CDT