[gmx-users] Dangling bond error for dna
majid hasan
pu_majidhasan at yahoo.com
Sun Apr 10 05:47:40 CEST 2011
.pdb file size was big, so message didn't deliver. Now I have removed atoms from
pdb file to reduce the size, and the files are attached.
Thanks,
Majid
________________________________
From: Justin A. Lemkul <jalemkul at vt.edu>
To: Discussion list for GROMACS users <gmx-users at gromacs.org>
Sent: Sat, April 9, 2011 7:18:30 PM
Subject: Re: [gmx-users] Dangling bond error for dna
majid hasan wrote:
> Dear All,
>
> I created .pdb file for dna using gabedit. But when I try to create the
>topology file I get this error: Fatal error:
> There is a dangling bond at at least one of the terminal ends and the force
>field does not provide terminal entries or files. Edit a .n.tdb and/or .c.tdb
>file.
>
> Output of pdb2gmx, and my input pdb files are attached. Could anyone please
>suggest why this is happening?
>
Nothing is attached.
-Justin
> Thanks,
> Majid
>
-- ========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
========================================
-- gmx-users mailing list gmx-users at gromacs.org
http://lists.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search
before posting!
Please don't post (un)subscribe requests to the list. Use the www interface or
send it to gmx-users-request at gromacs.org.
Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20110409/63a09ab0/attachment.html>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: dna6_atomsremoved.pdb
Type: application/octet-stream
Size: 11401 bytes
Desc: not available
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20110409/63a09ab0/attachment.obj>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: dangling bond error_output of pdb2gmx
Type: application/octet-stream
Size: 8290 bytes
Desc: not available
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20110409/63a09ab0/attachment-0001.obj>
More information about the gromacs.org_gmx-users
mailing list