[gmx-users] Error while running grompp command

[Bratin Kumar Das]

Please send the entire error message

On Sun 17 Feb, 2019, 8:16 PM Nath, Dinesh <Dinesh.Nath-1 at ou.edu wrote:

> Hello,
>
> I am running the gmx grompp -f ions.mdp -c solv.gro -p topol.top -o
> ions.tpr
>
> And this is the error I am getting:
>
> ERROR 1 [file rew.prm, line 36]:
>   Encountered a second block of parameters for dihedral type 9 for the same
>   atoms, with either different parameters and/or the first block has
>   multiple lines. This is not supported.
>
> Any advice to fix it.
>
> Thank you in advance.
>
>
> __________________________________
> Dinesh Nath, Ph.D.
> The University of Oklahoma
> Postdoctoral Research Fellow
> Department of Chemistry & Biochemistry
> Institute for Natural Products Applications
> & Research Technologies (INPART)
> 101 Stephenson Parkway
> Norman, OK 73019
> (412) 908-3476
> dinesh.nath-1 at ou.edu<mailto:dinesh.nath-1 at ou.edu>
>
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