[gmx-users] Fwd: setting ionic liquid simulation in gromacs

Bratin Kumar Das 177cy500.bratin at nitk.edu.in
Sat Dec 21 03:22:48 CET 2019


Hi
    What error you are getting?

On Fri 20 Dec, 2019, 1:14 PM Devargya Chakraborty, <
devargyachakraborty.kgp at gmail.com> wrote:

> ---------- Forwarded message ---------
> From: Devargya Chakraborty <devargyachakraborty.kgp at gmail.com>
> Date: Thu, 19 Dec 2019 at 18:17
> Subject: setting ionic liquid simulation in gromacs
> To: <gmx-users at gromacs.org>
>
>
> can any body guide me or tell me the steps for the simulation of ionic
> liquid and how to properly use the .itp files available for the cations and
> anions. i am getting error while setting the force-field of the ionic
> liquid. any help regarding the topic will be welcomed.
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