[gmx-users] (no subject)

HANNIBAL LECTER hanniballecter13 at gmail.com
Thu May 22 17:03:15 CEST 2014


You should provide with more information. The error message clearly states
that there are multiple definitions for the moleculetype CU1. You should
check carefully for redundancies in the top file


On Wed, May 21, 2014 at 2:57 AM, Meenakshi Rajput
<ashi.rajput39 at gmail.com>wrote:

> dear gromacs users
> I tried to add ions to my .gro file as it was showing the warning that:-
> System has non zero charge.
> But a new error occured when i run grompp command again:-
>  Program grompp_d, VERSION 4.6.3
> Source code file: /build/buildd/gromacs-4.6.3/src/kernel/toppush.c, line:
> 1412
>
> Fatal error:
> moleculetype CU1 is redefined
> For more information and tips for troubleshooting, please check the GROMACS
> website at http://www.gromacs.org/Documentation/Errors
> Please help me...
> --
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