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