[gmx-users] Fwd: help

vineetha mandlik vinee2here at gmail.com
Sat Apr 21 18:02:43 CEST 2012


---------- Forwarded message ----------
From: vineetha mandlik <vinee2here at gmail.com>
Date: Sat, Apr 21, 2012 at 9:22 PM
Subject: help
To: gmx-users-request at gromacs.org


Respected Sir/Madam

I am new to gromacs and on giving the grompp command after genion command I
am getting the following error:



Even after running the genion command and adding 4 Na+ ions before the
grompp command i still get

Note: the system has non zero charge: -4.99998e+0.0 and then this error..

Number of coordinates in coordinate file (x_b4em.gro,24736) does not match
topology (x.top,247535).


so can you help me in resolving this issue..


Any help in this regard will be highly appreciated.
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