[gmx-users] Is it possible to generate lipid.itp with Charmm36 ff?

Yunlong Liu yliu120 at jhmi.edu
Tue Apr 7 23:29:34 CEST 2015


Hi Micholas,

I will try it but last time when I tried, the charm-Gui was not working.

Yunlong

Sent from my iPhone

> On Apr 7, 2015, at 4:21 PM, Smith, Micholas D. <smithmd at ornl.gov> wrote:
> 
> If you mean you want to set up the system for using Charmm36's parameters, you might be able to use the Charmm-GUI (Wonpil Im's group)
> 
> -Micholas
> 
> ===================
> Micholas Dean Smith, PhD.
> Post-doctoral Research Associate
> University of Tennessee/Oak Ridge National Laboratory
> Center for Molecular Biophysics
> 
> ________________________________________
> From: gromacs.org_gmx-users-bounces at maillist.sys.kth.se <gromacs.org_gmx-users-bounces at maillist.sys.kth.se> on behalf of Yunlong Liu <yliu120 at jh.edu>
> Sent: Tuesday, April 07, 2015 4:18 PM
> To: gromacs.org_gmx-users at maillist.sys.kth.se
> Subject: [gmx-users] Is it possible to generate lipid.itp with Charmm36 ff?
> 
> Hi,
> 
> I am doing membrane-protein simulation with Charmm36 forcefield. I would
> like to know whether I can generate the lipid force field with Charmm36
> by some available tools?
> 
> Yunlong
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