Re: atom type

From: Chris Harrison (charris5_at_gmail.com)
Date: Fri Nov 19 2010 - 09:39:56 CST

Dear Maria,

Do you mean you want to assign the name "C=O" to a single atom? If
not, please send a list of the atoms whose atom names you want to
change as: Element Name, Regular Atom Name, Your New Atom Name

Best,
Chris

On Fri, Nov 19, 2010 at 9:14 AM, <matziast_at_med.uth.gr> wrote:
> Hi,
> I use the CHARMM 27 force field for my simulations and I want to give at the
> atoms of the new residue names that don't exist. So I must be sure if the name
> C=O can be read from the program.
> Thank you,
> Maria
>

-- 
Chris Harrison, Ph.D.
Theoretical and Computational Biophysics Group
NIH Resource for Macromolecular Modeling and Bioinformatics
Beckman Institute for Advanced Science and Technology
University of Illinois, 405 N. Mathews Ave., Urbana, IL 61801
char_at_ks.uiuc.edu                            Voice: 217-244-1733
http://www.ks.uiuc.edu/~char               Fax: 217-244-6078

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