Subject: Help with MOE

From: SANDEEP KUMAR <skumar23 ## jhem.jhu.edu>
Date: Thu, 30 Jun 2005 11:29:30 -0400

Hello: 

I was wondering if there is a simple way to set the pH for a protein-ligand complex in MOE (Molecular Operations Environment from CCG) for the purpose of molecular electrostatics and simulations calculations.  

Any input shall be greatly appreciated. 

Yours sincerely, 
Sandeep Kumar

-------------------------------------------------------------------
Dr. Sandeep Kumar, 
Associate Research Scientist, 
Johns Hopkins University Department of Biology, 
106 Mudd Hall, 3400 N. Charles Street, 
Baltimore, MD 21218,  USA. 
Phone: 410-516-8433,
Email: kumarsan ## jhu.edu.
URL:  http://myprofile.cos.com/Kumarsan.
or      https://jshare.johnshopkins.edu/skumar23/public_html/