[gmx-users] Request to solve this fatal error-reg

Justin A. Lemkul jalemkul at vt.edu
Tue May 17 19:22:02 CEST 2011



ITHAYARAJA wrote:
> Dear Sir,
> 
> Greetings!
> 
> I found the following error while preforming pdb2gmx command,
> 
> Fatal error:
> Incomplete ring in HIS-3
> 
> 

You have an incomplete starting structure.  In order for pdb2gmx to work, you 
need an intact coordinate file.  If your input is a .pdb file, it may contain 
REMARK 465 or 470 lines regarding missing atoms/residues.

-Justin

> I request you to do your best as possible as earlier.
> 
> 
> Thanks in advance.......
> 
> 
> -- 
> **
> Ithayaraja M,
> Research Scholar,
> Department of Bionformatics,
> Bharathiar University,
> Coimbatore 641 046,
> Tamil Nadu
> India
> 

-- 
========================================

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

========================================



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