[gmx-users] Calculation stopping

[David]

On Mon, 2003-08-04 at 17:20, Tanos wrote:
>             Hi folks, 
> 
>             Lately I have faced a very strange problem when using
> GROMACS: My MD calculations stop without any apparent reason. I am
> trying 100 ps of MD in a system of 130.000 atoms, but when calculation
> reaches about step 25000, it suddenly stops without any error message.
> The files .job and .log remain unchanged as the calculation was yet
> on. Does someone has any idea of what can be happening ???????? 
2Gb files?

> 
>             Thanks in advance.
> 
>             Tanos C. C. Franca
> 
>             IME – Rio de Janeiro - Brazil
> 
> 
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-- 
Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, 	Dept. of Cell and Molecular Biology
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
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