[gmx-users] Fatal error, please help (2)

[Hua Wong]

Finally I cross checked again. Didn't find anything relevant... and decided to rebuild the ndx file from scrap using the same constrained zone. 

It run just fine now.

Maybe I have mixed up files when transfering from my workstation to the calculation cluster.

Thanks for asking nonetheless.

On Thu, Mar 11, 2004 at 02:50:00PM +0100, Anton Feenstra wrote:
> Hua Wong wrote:
> 
> >This will certainly give a big mail, but I send it nonetheless because I 
> >can't find any idea about the fatal error displayed by grompp.
> >
> >Fatal error: Atom 1673 in multiple Freeze groups (17 and 1)
> >
> >Here is my ndx file. I really don't know what is happening.
> >It worked well some times before...
> 
> Your index groups look fine. How is your .mdp file composed?
> 
> 
> -- 
> Groetjes,
> 
> Anton
>  _____________ _______________________________________________________
> |             |                                                       |
> |  _   _  ___,| K. Anton Feenstra                                     |
> | / \ / \'| | | Dept. of Pharmacochem. - Vrije Universiteit Amsterdam |
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> | \_/ \_/ | | | Tel: +31 20 44 47608 - Fax: +31 20 44 47610           |
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