Dear Amber users,
I got the following error, at the time of
running QM/MM calculation of protein -ligand complex. I dont know what is
the solution of that problem. the error is.
*Sum of charges from parm topology file = -2.99899913*
*Assuming uniform neutralizing plasma*
*Running AMBER/MPI version on 40 nodes*
*| WARNING: The number of processors is not a power of 2*
*| this may be inefficient on some systems.*
*please help to run the job.*
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M.SIVANANDAM
Research Scholar
Department of Physics
School of Physical Sciences
Periyar University
Salem-636 011
Mobile- 9965582730, 9042066076
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M.SIVANANDAM
Research Scholar
Department of Physics
School of Physical Sciences
Periyar University
Salem- 636 011.
Mobile- +91 9042066076, 9965582730.
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Received on Mon Nov 02 2015 - 05:00:07 PST
