Hi,
When I run
mpirun -np 2 sander [options]...
I get an error message:
unknown flag: -p4pg
I found some information that suggest mdfil.f in
sander source directory might need to be modified
to ignore this flag.
How do I do this exacly? Or do you have a patch for
this problem?
Thank you,
Mark
Received on Thu Apr 18 2002 - 16:12:58 PDT
