Hi amber users,
I encountered the error of parallel calculations. I use the ifort compiler to compile amber, and also using mpich2 as parallel software. After compiling parallel vertion of amber, I run sander.MPI, but I got the error like this:
application called MPI_Abort(MPI_COMM_WORLD, 1) - process 0[unset]: aborting job:
application called MPI_Abort(MPI_COMM_WORLD, 1) - process 0
I don't know what's the problem, can someone help me to figure it out? Any response will be appreciated.
All the best,
Qinghua Liao
fantastic_0919.yahoo.com.cn or fantasticqhl.yahoo.com
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Received on Mon Jul 06 2009 - 09:38:14 PDT
