VMD-L Mailing List

From: Nick Palmer (tuf90798_at_temple.edu)
Date: Thu May 24 2018 - 15:40:08 CDT

Hello,

I am trying to run simulations on an NMR structure and I would like to
apply contraints based on the NMR constraints file. I have been looking for
some time now, and all I have come up with is that xplor-vmd may have the
answers I am looking for. I would like to know if there is a way I can
extract the information from the .mr file in any way and apply it to
constrain the protein during simulations sticking with just vmd.

Thank you in advance. 

-- 
Nicholas J. Palmer