[gmx-users] preapration of non-standard residue

Mark Abraham mark.j.abraham at gmail.com
Thu Jan 7 18:34:09 CET 2016


Hi,

Please see
http://www.gromacs.org/Documentation/How-tos/Adding_a_Residue_to_a_Force_Field

Mark

On Thu, Jan 7, 2016 at 4:46 PM Marta Wisniewska <
marta.d.wisniewska at gmail.com> wrote:

> Dear Gromacs Users,
>
> I'd like to prepare my system for MD simulations. I have non-standard
> residue. I prepared a topology and coordinates by antechamber. I know, I
> should add it to itp file. But what exactly I should do?
>
>
> Thank you in advance,
> Marta
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