On Thu, May 6, 2010 at 8:22 AM, jaya c.jose <jayacjose.gmail.com> wrote:
> Dear All,
>
> During the installation of Amber10 I faced a problem while installing the
> PMEMD.I compiled it successfully but when I gave the command 'make install'
> it prompts.
>
It sounds like configure worked properly, but that it failed to compile,
since the message below is clearly an error. You should make sure that
MPI_HOME is correctly set and that, like Professor Case said, MPI_INCLUDE
points to an include directory that contains the file mpif.h .
Also, if you have not edited the config.h file at all, you should use mpif90
as your fortran compiler and your load variable. Can you send the config.h
file you're using?
All the best,
Jason
>
> make[1]: Entering directory
> `/storage/home/nsengupta/AMBER/amber10/src/pmemd/src'
> /lib/cpp -traditional -P
> -I/opt/intel/mkl/10.0.3.020/lib/em64t//include-DPUBFFT -DMPI
> -DDIRFRC_EFS -DDIRFRC_COMTRANS -DDIRFRC_NOVEC -DMKL
> -DFFTLOADBAL_2PROC pmemd_lib.fpp pmemd_lib.f90
> pmemd_lib.fpp:40: error: mpif.h: No such file or directory
> make[1]: *** [pmemd_lib.o] Error 1
> make[1]: Leaving directory
> `/storage/home/nsengupta/AMBER/amber10/src/pmemd/src'
> make: *** [install] Error 2
>
> So how can I proceed from this point.
>
> Thanking You
> Jaya
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>
--
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Graduate Student
352-392-4032
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Received on Thu May 06 2010 - 06:00:06 PDT
