From: Akshay Bhatnagar (akshaybhatnagar2790_at_gmail.com)
Date: Mon Nov 10 2014 - 07:05:40 CST
Can anyone please tell me how can i perform QM/MM calculation for my system
(pdb file with cystine as solute and remaining part of micro-environment
around that cystine as solvent ). I don't know how to prepare the input
file and how ti run it in NAMD.
BITS Pilani Hyderabad Campus
This archive was generated by hypermail 2.1.6 : Thu Dec 31 2015 - 23:21:21 CST