[gmx-users] sorry... installation problem

Alan Dodd anoddlad at yahoo.com
Tue Sep 27 13:44:07 CEST 2005


Out of interest... Any ideas what the relevant
variables to provide paths are for fftw installation? 
I can only find output path options in the manual.

--- leafyoung81-group at yahoo.com wrote:

> Check config.log for what wrong has happened.
> 
> Did you use "CFLAGS=-I/usr/lam's include directory"
> and LDFLAGS=-L/usr/lam's lib directory"?
> 
> Yang Ye
> 
> --- Jeroen Mesters <mesters at biochem.uni-luebeck.de>
> wrote:
> 
> > Hi,
> > 
> > sorry, but the archieves did not provide an
> answer.
> > 
> > We have several dell precisions 650 (dual xeon)
> > running under SuSE 9.2. 
> > No Beowolf or so installed. We just want to run
> > gromacs using the 2 
> > processors on the single machines.
> > 
> > I installed lam-6.5.4-usysv.1.i386.rpm,
> > fftw-2.1.3-2.i386.rpm, 
> > fftw-devel-2.1.3-2.i386.rpm,
> > fftw-lammpi-2.1.3-2.i386.rpm, and 
> > fftw-lammpi-devel-2.1.3-2.i386.rpm.
> > No problem so far. Installing gromacs-3.2.1 with
> the
> > --enable-mpi flag 
> > does not work (it work without this flag) and it
> > always stops at the 
> > following lines:
> > 
> > checking size of long long... (cached) 8
> > checking whether cc accepts
> > -fkeep-programmers-inline... no
> > checking whether cc accepts
> -vomit-frame-pointer...
> > no
> > checking for mpicc... (cached) mpicc
> > checking for MPI_Init... no
> > checking for MPI_Init in -lmpi... no
> > configure: error: couldn't find mpi library for
> > --enable-mpi
> > 
> > I tried to install it from scratch (using
> > lam-6.5.4.tar, fftw-2.1.3.tar 
> > and gromacs-3.2.1.tar) but it stops at exactly the
> > same lines.
> > 
> > What am I overlooking here?
> > 
> > Regards, Jeroen.
> > 
> > -- 
> > Jeroen Raymundus Mesters, Ph.D.
> > Institut fuer Biochemie, Universitaet zu Luebeck
> > Ratzeburger Allee 160, D-23538 Luebeck
> > Tel: +49-451-5004070, Fax: +49-451-5004068
> > E-mail: mesters at biochem.uni-luebeck.de
> > Http://www.biochem.uni-luebeck.de
> > --
> > If you can look into the seeds of time and say
> > which grain will grow and which will not - speak
> > then to me  (Macbeth)
> > --
> > 
> > _______________________________________________
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> 
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