[gmx-users] Running Gromacs in parallel with fftw

[Peter C. Lai]

On Thu, May 26, 2005 at 04:35:50PM -0300, Lin Zhen wrote:
> Dear all,
> 
>     I am trying to running Gromacs in parallel, so I configure it with
> --enable-mpi, it always shows the error message:
> 
> checking for srfftw.h... yes
> checking for sfftw_mpi.h... no
> configure: error: Cant find sfftw_mpi.h header. Make sure all your
> fftw prefixes match - we already use sfftw.h
> 
> But we have installed sfftw_mpi.h in the same folder as srfftw.h,
> don't know why it couldn't find it.

does it fail when looking for mpicc? Make sure the path to mpicc is
in your path before you start the configure

-- 
Peter C. Lai
University of Connecticut
Dept. of Molecular and Cell Biology
Yale University School of Medicine
SenseLab | Research Assistant
http://cowbert.2y.net/