[gmx-users] gmx 4.5 configure options confusing

Rossen Apostolov rossen.apostolov at cbr.su.se
Wed Aug 4 09:54:34 CEST 2010


  Hi,

This was a typo in configure.ac, the second line should say 
--without-qmmm-orca.

Fixed it for the next release. Thanks for reporting.

Rossen

On 7/31/10 12:11 PM, Alan wrote:
> For gmx 4.5 beta, I see with ./configure --help:
>
>   --without-qmmm-mopac    Use modified Mopac 7 for QM-MM (see website)
>   --without-qmmm-mopac    Use ORCA for QM-MM
>
> What that really means?
>
> Thanks,
>
> Alan
>
> -- 
> Alan Wilter S. da Silva, D.Sc. - CCPN Research Associate
> Department of Biochemistry, University of Cambridge.
> 80 Tennis Court Road, Cambridge CB2 1GA, UK.
> >>http://www.bio.cam.ac.uk/~awd28 <http://www.bio.cam.ac.uk/%7Eawd28><<




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