AMBER Archive (2004)

Subject: Re: AMBER: pmemd config.h request for athlon

From: Robert Duke (rduke_at_email.unc.edu)
Date: Fri Aug 13 2004 - 13:42:42 CDT


Madalin -
One other thing - Don't simply try hacking up the ifort p4 config file as
Ross suggests. There are code optimizations for the pentium that would
still be used (the optimization defines), which will actually make for
slower code on the athlon (or at least on the ones I have).
Regards - Bob

----- Original Message -----
From: "Madalin Giambasu" <giambasu_at_biochim.ro>
To: <amber_at_scripps.edu>
Sent: Friday, August 13, 2004 1:47 PM
Subject: AMBER: pmemd config.h request for athlon

>
> Does anyone have a pmemd config.h for athlon ?
>
>
> I have installed ifort8 from l_fc_pc_8.0.046.tar.gz, compiled pmemd
> but i am still receiving errors:
>
> make test.pmemd
> export TESTsander='../../exe/pmemd'; cd 4096wat; ./Run.pure_wat
> forrtl: severe (168): Program Exception - illegal instruction
> Image PC Routine Line Source
> pmemd 08083C8F Unknown Unknown Unknown
> pmemd 42015574 Unknown Unknown Unknown
> pmemd 0804A391 Unknown Unknown Unknown
> ./Run.pure_wat: Program error
> make: *** [test.pmemd] Error 1
>
> Unfortunately I didnot have a config.h for athlon I have used that from
> the Amber site.
>
>
>
>
> -------------------------------------------------------
> Madalin G. Giambasu
> Junior Research Assistant
> Institute of Biochemistry of Romanian Academy of Science
> Splaiul Independentei 296, 060031, Bucharest 17, Romania
> Phone: (+4)021.223.90.69; FAX: (+4)021.223.90.68
>
> -------------------------------------------------------
>
>
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