AMBER: failure in testing amber8 parallel parts on IBM-SP4 machines

From: Rachel <comeonsos.googlemail.com>
Date: Fri, 24 Nov 2006 17:58:53 +0000

Dear all,

When I use 'make test.sander' in $AMBERHOME/test for the amber8 parallel
parts on IBM_SP4 machines, I got the following error messages, I searched in
the mailing list, and found out that the should be related to "mpi
installation and compilation". The system I am using is a standard IBM's AIX
operating system. Can anyone suggest what is the reason for the errors and
how can I correctly test the parallel part? Thanks a lot.

######################################################################
        cd dmp; ./Run.dmp
This test not set up for parallel
 cannot run in parallel with #residues < #pes
        cd adenine; ./Run.adenine
This test not set up for parallel
 cannot run in parallel with #residues < #pes
==============================================================
        cd cytosine; ./Run.cytosine
mpirun: Command not found.
  ./Run.cytosine: Program error
make: 1254-004 The error code from the last command is 1.


Stop.
bash-2.05a$ make test.sander
        cd dmp; ./Run.dmp
This test not set up for parallel
 cannot run in parallel with #residues < #pes
        cd adenine; ./Run.adenine
This test not set up for parallel
 cannot run in parallel with #residues < #pes
==============================================================
        cd cytosine; ./Run.cytosine
mpirun: Command not found.
  ./Run.cytosine: Program error
make: 1254-004 The error code from the last command is 1.

Stop.
######################################################################

With my best regards,
Rachel

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Received on Sun Nov 26 2006 - 06:07:26 PST
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