Howdy,
I've compiled MVAPICH on my system (so I can utilize the Infiniband
cards) using the Intel 9.1 compilers.
I compiled Amber9 serial with the Intel compilers and successfully run
the "make test.serial" tests.
For parallel I ran:
./configure -mpich -p4
I changed in config.h the references to:
gcc --> mpicc
g++ --> mpiCC
ifort --> mpif77
And then add -I/share/mvapich/include to the CPPFLAGS variable
The make parallel appears to finish without errors however when I
attempt to run:
sander.MPI -help
I get a bunch of segmentation faults. Any idea what I should look at?
Is the configure option correct (-mpich)?
thanks,
Mike
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Received on Wed Feb 07 2007 - 06:07:41 PST
