[gmx-users] Configuration on an IBM power computer

David van der Spoel spoel at xray.bmc.uu.se
Mon Aug 28 19:45:03 CEST 2006


Volker Knecht wrote:
> Dear all,
> 
> I have a problem with the configuration of gmx3.3 on an IBM power 
> computer which was reported in here in the mailing list previously by 
> Xie Yinghong. When trying to configure a parallel version of gmx on an 
> IBM power computer with operating system AIX, I recieve the error
> 
>    "cannot compute sizeof (int)".
> 
> I have contacted Xie Yinghong who told me that this problem only occurs 
> with the parallel and not with the sequential version. He could not 
> solve the problem, but, rather, uses gmx3.2 now for which the problem 
> does not occur. This is, however, no option for me, as I want to use a 
> feature not implemented in gmx3.2 yet.
> 
> Does anyone have any idea how to solve this problem?
> 
> Your help would be greatly appreciated.
> 
> Kind regards,
> Volker
> 
Since you're at a Max Planck address I'd suggest you contact the staff 
at the Rechenzentrum in Garching, they have been involved in some 
GROMACS developments as well and they know the machine.


-- 
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
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++



More information about the gromacs.org_gmx-users mailing list