[gmx-users] Multi-atomic ion support for computational electrophysiology

Barnett, James W jbarnet4 at tulane.edu
Mon Sep 14 15:05:30 CEST 2015

On Sat, 2015-09-12 at 23:52 +0530, mishtu at iitk.ac.in wrote:
> Hi,
> I wanted to use computational electrophysiology for a channel protein
> which permeates multi-atomic ions.
> A post by the developer in the mailing list said that the patch which
> includes support for multi-atomic ions would be made available in the
> gromacs 5.1 release
> (https://mailman-1.sys.kth.se/pipermail/gromacs.org_gmx-developers/20
> 14-December/008121.html),
> but its not here yet.
> When can I expect to get this patch? Otherwise, can someone suggest
> me a
> workaround to this problem?

I suggest sending a message to that individual developer.

James “Wes” Barnett, Ph.D. Candidate
Louisiana Board of Regents Fellow

Chemical and Biomolecular Engineering
Tulane University
341-B Lindy Boggs Center for Energy and Biotechnology
6823 St. Charles Ave
New Orleans, Louisiana 70118-5674
jbarnet4 at tulane.edu

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