[gmx-users] Regarding Segmentation fault during mdrun_d
Mark.Abraham at anu.edu.au
Thu Aug 4 10:34:31 CEST 2011
On 4/08/2011 5:03 PM, Ravi Kumar Venkatraman wrote:
> Dear All,
> I was trying to run NVT equilibration for cyclohexane.
> When I started running it shows following error
> Reading file nvt.tpr, VERSION 4.5.4 (double precision)
> Starting 2 threads
> Making 1D domain decomposition 2 x 1 x 1
> starting mdrun 'Cyclohexane box'
> 50000 steps, 100.0 ps.
> Segmentation fault.
> Please suggest me something to overcome this.
Depends what is going wrong. Consult the .log file.
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