[gmx-users] does --with-external-blas --with-external-lapack work?
Erik Lindahl
lindahl at sbc.su.se
Mon Nov 21 17:05:27 CET 2005
Hi,
All vendors recommend that you use their tuned routines :-)
There's nothing wrong with that per se, but when it's not performance-
sensitive we prefer not to rely on too many external libraries since
it makes debugging a nightmare. Still, we will make sure it works as
an option.
Cheers,
Erik
On Nov 21, 2005, at 3:13 PM, Jack Howarth wrote:
> Eric,
> Apple recommends that if you need lapack or blas routines that
> vecLib be used as it is optimized for the cpu features of each
> machine.
>
> http://developer.apple.com/hardware/ve/vector_libraries.html
>
> I am interested in benchmarking the internal rountines in gromacs
> vs Apple's. If they are the same, it seems rational to have the
> MacOS X build just use vecLib.
> Jack
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-----------------------------------------------------------
Erik Lindahl <lindahl at sbc.su.se>
Assistant Professor, Stockholm Bioinformatics Center
Stockholm University, SE 106 91 Stockholm
Phone: +46 8 5537 8564 Fax: +46 8 5537 8214
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