[gmx-users] UNABLE TO GENERATE TOPOLOGY

Robert Selwyne Robert.Selwyne at mpikg.mpg.de
Tue Apr 17 10:10:05 CEST 2007


Hi
try this command
pdb2gmx -f Fe.pdb -p Fe.top

Regards
Robert

> Hi ! can anyone help?
> how can I generate a topology file a single atom "Fe" for use in gromacs.
>
> Thanks in advance,
> --Subhrangshu
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