Dear Amber users and developers,
I am trying to install Amber11 for parallel calculation,
But I encountered following error message in install process.
dsarpack.f(615): (col. 17) remark: LOOP WAS VECTORIZED.
mpicc -c -ip -O3 -axSTPW -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -DMPI
-I/home/kurisaki/mpich2-install/include -o wallclock.o wallclock.c
cc1: error: unrecognized command line option "-ip"
cc1: error: unrecognized command line option "-axSTPW"
make[2]: *** [wallclock.o] Error 1
make[2]: Leaving directory
`/home/kurisaki/amber/amber11_IK_ifort_Parallel/AmberTools/src/arpack'
make[1]: *** [netlib] Error 2
make[1]: Leaving directory
`/home/kurisaki/amber/amber11_IK_ifort_Parallel/src/sander'
make: *** [parallel] Error 2
Error message suggests mpicc cannot recognize some frags and
This subroutine would be needed to treat eigen value problem.
Does any problems arise if we skip the compiling dsarpack.f?
I am most grateful if you tell me resolution to finish compile.
Ikuo Kurisaki
PS
We use Intel compiler and MPICH2 here.
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Received on Tue Sep 27 2011 - 21:00:02 PDT