CCL: free energy calculations
- From: jaleel uc <jaleel.uc*o*gmail.com>
- Subject: CCL: free energy calculations
- Date: Sun, 4 Apr 2010 16:54:57 +0530
but we can do in hyperchem
On Sun, Apr 4, 2010 at 1:24 PM, Kshatresh Dutta Dubey
Can we claculate the free energy for the output of QM/MM calculations
performed by Qsite (Schrodinger Inc.).
Every help is heartly appreciated.
lecturer in cheminformatics
Malabar christian college