[gmx-users] Incomplete ring
Justin Lemkul
jalemkul at vt.edu
Mon Jul 27 13:48:12 CEST 2015
On 7/27/15 7:05 AM, hari ram wrote:
>
>
>
> Hi Users,
>
> I have a .pdb file, in this file when I want to use pdb2gmx command there is this error massage:Fatal error:
> Incomplete ring in HIS771
>
> this aminoacid is not complete in general, I don't know how can I
> complete this such that I don't add HIS for complete? Please give me a
> hint.
>
http://www.gromacs.org/Documentation/File_Formats/Coordinate_File#Sources
-Justin
--
==================================================
Justin A. Lemkul, Ph.D.
Ruth L. Kirschstein NRSA Postdoctoral Fellow
Department of Pharmaceutical Sciences
School of Pharmacy
Health Sciences Facility II, Room 629
University of Maryland, Baltimore
20 Penn St.
Baltimore, MD 21201
jalemkul at outerbanks.umaryland.edu | (410) 706-7441
http://mackerell.umaryland.edu/~jalemkul
==================================================
More information about the gromacs.org_gmx-users
mailing list