Help with MOE
- From: SANDEEP KUMAR <skumar23 ## jhem.jhu.edu>
- Subject: Help with MOE
- 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
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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/