Re: [gmx-users] question about installing gromacs on a mac

2010-05-06 Thread Esztermann, Ansgar
On May 5, 2010, at 18:15 , Emily Curtis wrote: > > checking for mkl.h... yes > checking for DftiComputeForward in -lmkl... no > configure: error: Cannot find Intel Math Kernel Library >= 6.0 > > > I don't understand why it is not finding my Math Kernal Library. I also do > not understand what

Re: [gmx-users] question about installing gromacs on a mac

2010-05-05 Thread J. Rui Rodrigues
Hi, I have never tried to compile gromacs with MKL, but you could try to configure with CFLAGS="-framework mkl" Hope this helps, Rui Rodrigues On Wed, 5 May 2010 12:15:23 -0400, Emily Curtis wrote > I apologize in advance if this is a very stupid question. I am trying to > configure GROMACS

[gmx-users] question about installing gromacs on a mac

2010-05-05 Thread Emily Curtis
I apologize in advance if this is a very stupid question. I am trying to configure GROMACS on a mac. I have the intel MKL installed. *When I type the following:* ./configure --with-fft=mkl CPPFLAGS="-I/Developer/opt/intel/Compiler/11.1/067/Frameworks/mkl/include" LDFLAGS="-L/Developer/opt/intel