[gmx-users] cannot rename checkpoint file

Justin A. Lemkul jalemkul at vt.edu
Mon Jan 24 15:53:33 CET 2011



ram bio wrote:
> Dear Gromacs users,
> 
> I am running an all-atom simulation of protein-ligand complex in lipid
> bilayer on a server, while running the  job after some time, my job
> terminates with an error as under:
> 
> Program mdrun, VERSION 4.0.3
> Source code file: checkpoint.c, line: 859
> 
> File input/output error:
> Cannot rename checkpoint file; maybe you are out of quota?
> 
> Please suggest how to overcome this error.
> 

The error suggests you are out of disk space.  Is this the case?  Otherwise, I'd 
suggest upgrading your Gromacs version.  Dozens of bugs have been fixed.

-Justin

> Best,
> 
> Ram

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

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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