Hi,

Am 25.03.2010 um 11:30 schrieb sun...@chem.iitb.ac.in:

> Openmpi is installed in a Intel Xeon quad core 2.4Ghz machine loaded with
> Red Hat Enterprise Linux 5. The loaded openmpi version is 1.2.5. While
> trying to install CHARMM software, it asked for the path of mpi.h file and
> library files libmpi. I didn't find 'include' folder in the openmpi folder
> which contains all the header files like mpi.h. However, it contains
> 'bin', 'etc', 'lib' and 'share' sub-folders.

maybe only the runtime package and not the developer package was installed. Due 
to the ancient version you have, I would suggest to download the actual source 
and install on your own with:

$ ./configure --prefix=/home/patel/local/openmpi-1.4.1

and after a "make" and "make install" you can access the actual header and 
library files. For CHARMM ist might be necessary to supply the path to the 
include files with -I/home/patel/local/openmpi-1.4.1/include in CFLAGS and the 
path to your libs in LDFLAGS -L/home/patel/local/openmpi-1.4.1/lib (names maybe 
different in CHARMM though).

As long as you built the dynamic version, it's necessary to supply a runtime 
also an export 
LD_LIBRARY_PATH=/home/patel/local/openmpi-1.4.1/lib:$LD_LIBRARY_PATH

-- Reuti

> 
> It looks like that mpi.h file does not exist. Which version of openmpi has
> the mpi.h header file?
> 
> Any help would be appreciated.
> 
> Regards,
> Dr. Sunita Patel
> ---------------------------------------------
> Visiting Fellow
> Department of Chemical Sciences
> T.I.F.R., Homi Bhabha Road, Colaba
> Mumbai - 400005
> ---------------------------------------------
> 
> 
> 
> 
> 
> 
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