[AMBER] ptraj in parallel

From: Fabrício Bracht <bracht.iq.ufrj.br>
Date: Tue, 28 Jun 2011 15:06:06 -0300

I am having some troubles in finding a solution to this problem.
Everytime I run the command "mpirun -np 2 ptraj input.prmtop <
script.trajin", I get the following

Version: "AMBER 11.0 integrated" (4/2010)
  -/- Executable is: "ptraj.MPI"
  /-\ Running on 2 processor(s)
  \-/ MULTIPTRAJ must be run with <TOP> and <INPUT>.

Something seems to be wrong with my input command line, but what?
Thank you
Fabrício Bracht

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Received on Tue Jun 28 2011 - 11:30:04 PDT
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