[gmx-users] Mac OS X with MKL

Justin A. Lemkul jalemkul at vt.edu
Wed May 5 22:15:32 CEST 2010

Emily Curtis wrote:
> Hi.  I am also trying to build Gromacs with MKL on a Mac OS X.  I get the same error that you reported:
> checking for mkl.h... yes
> checking for DftiComputeForward in -lmkl... no
> configure: error: Cannot find Intel Math Kernel Library >= 6.0
> Did you ever figure out how to fix this?  I would really appreciate your help.

I don't have much to contribute other than that this has been an issue for a 
long time apparently:


Those are the only tips I could find in the archive.

Try using FFTW instead, maybe :)


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Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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