[gmx-users] Error in production run

[Malai]

Hi Justin,

Thanks. I will have a look at this link.

On Thu, Jun 14, 2012 at 12:27 AM, Justin A. Lemkul <jalemkul at vt.edu> wrote:

>
>
> On 6/13/12 12:21 PM, Malai wrote:
>
>> Hi,
>>
>> Can you suggest me what went wrong in my production run . I got the
>> following
>> error that stopped my run. Thanks.
>>
>>
> http://www.gromacs.org/**Documentation/Terminology/**Blowing_Up<http://www.gromacs.org/Documentation/Terminology/Blowing_Up>
>
> -Justin
>
>
>  ------------------------------**-------------------------
>> Program mdrun_mpi, VERSION 4.5.4
>> Source code file: domdec.c, line: 2861
>>
>> Fatal error:
>> The X-size of the box (6.311743) times the triclinic skew factor
>> (1.000000) is
>> smaller than the number of DD cells (6) times the smallest allowed cell
>> size
>> (1.051861)
>>
>> For more information and tips for troubleshooting, please check the
>> GROMACS
>> website at http://www.gromacs.org/**Documentation/Errors<http://www.gromacs.org/Documentation/Errors>
>> ------------------------------**-------------------------
>>
>>
>>
> --
> ==============================**==========
>
> Justin A. Lemkul, Ph.D.
> Research Scientist
> Department of Biochemistry
> Virginia Tech
> Blacksburg, VA
> jalemkul[at]vt.edu | (540) 231-9080
> http://www.bevanlab.biochem.**vt.edu/Pages/Personal/justin<http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin>
>
> ==============================**==========
>
>
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