[gmx-users] (no subject)

[Mark Abraham]

Hi,

You don't need a file in the gro format. You need coordinates that match
the topology present in any supported file format, eg pdb or g96 etc.

Mark

On Tue, 20 Jun 2017 09:01 Shivangi Agarwal <shivangi.agarwal800 at gmail.com>
wrote:

> Hello
>
> I used the ATB server for generation of topology file following Gromacs
> Turorial
>
> http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin/gmx-tutorials/complex/02_topology.html
> <
> https://www.researchgate.net/deref/http%3A%2F%2Fwww.bevanlab.biochem.vt.edu%2FPages%2FPersonal%2Fjustin%2Fgmx-tutorials%2Fcomplex%2F02_topology.html
> >
>
> I need obtain two files .itp & .gro. I used the ATB server.
> https://atb.uq.edu.au/molecule.py?molid=225178#panel-md
>
> The server gave me many files (Topology Files and Structure Files).
> I am unable to see my "gro" file.
> Please help
> Your answer is highly appreciated.
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