Hi,
This post is in continuation to the
http://archive.ambermd.org/201009/0268.html, where Ross is suggesting two
solutions to the problem.
I compiled the static mpi using
"./configure_openmpi -static intel" script in /AmberTools/src directory.
Ideally speaking the '-fast' flag in the config.h should work for pmemd.
However the compilation stops exactly at place where Paul was also getting
error. Please suggest the solution to the problem.
Best
/Alok
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Received on Wed Oct 20 2010 - 13:00:04 PDT