[Dock-fans] spheres generation

Eric Pettersen pett at cgl.ucsf.edu
Wed Mar 25 10:32:15 PDT 2009


Did your original structure have residues in HETATM records?  If so  
you would want to use a current daily build of Chimera since I  
recently fixed a problem with Write DMS for such residues (the format  
of the output was wrong).  You can get a daily build from the Chimera  
home page (UCSF Chimera Home Page) by following the "Daily Builds" link.

--Eric

                         Eric Pettersen
                         UCSF Computer Graphics Lab
                         http://www.cgl.ucsf.edu


On Mar 25, 2009, at 12:02 AM, Marcello Mascini wrote:

> Dear All,
> I used the Write DMS Tool in Chimera for creating rec.dms file.
> But "sphgen" seems work only with file rec.ms!! how I can  
> transform .dms file in .ms file?
>
> I tried to change the file name in the INSPH from .ms to .dms but  
> when calculating rec.sph, which
> contains the spheres in clusters, and OUTSPH, the program send me a  
> string reporting that no clusters are found.
>
> Could anyone help me
> Thank you
> Regards
>
>
> Marcello Mascini PhD
> University of Teramo
> Department of Food Science
> Via Carlo R. Lerici, 1. 64023 Mosciano S. A.(TE).
> Italy
> Tel:+393478456234
> Fax: +39 0861266915
> http://www.unite.it
> mmascini at unite.it
> P Help save paper - do you need to print this email?
>
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