[gmx-users] wrong optimization result!!!

David van der Spoel spoel at xray.bmc.uu.se
Sat Oct 21 16:19:15 CEST 2006


zzhwise1 wrote:
> hi all
>     my system haa two monolayers ,when i set the two 1.5nm apart each 
> other ,it can optimize  smoothly,but the two monolayers turn over when 
> 1.2nm?
> and show segementation fault(core dump),anyone can help me?
> thanks !
>  

your message is not very clear.

problem can be due to anything

> 
> 
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-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
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://folding.bmc.uu.se
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