CCL: adding hydrogens
- From: Reaz Uddin <riaasuddin_._yahoo.com>
- Subject: CCL: adding hydrogens
- Date: Thu, 2 Aug 2007 09:23:18 -0700 (PDT)
I dont know what do you have in terms of molecular
modeling software. But Tripos sybyl can easily help you to add hydrogens. In
addditon to this, you can use opeeyes omega program. I guess opeyes babel can
also help you in this regard.
Hope it
helps You.
Thanks
REAZ
"Max Porrini
mozz76(0)gmail.com" <owner-chemistry=ccl.net> wrote:
Hi all
Does anybody know how I can add
hydrogens to a system?
I've downloaded the pdb file of a enzyme and there
aren't hydrogen atoms
(for instance the water molecule is formed only by the
oxygen).
I'd like to saturate my system with the missing hydrogens.
Any
tips will be very appreciated.
thanks a lot
MP
REAZUDDIN
Research Scholar
Department of Medicinal Chemistry
and Pharmacognosy,
College of Pharmacy, (M/C 781)
University of Illinois at Chicago
833 S. Wood St.
Chicago, IL 60612
Email: ruddin=uic.edu, riaasuddin=yahoo.com
Web:
http://medchem.pharm.uic.edu/
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