[gmx-users] Question about biphasic tutorial

James Lord jjamesgreen110 at gmail.com
Mon Jul 27 12:43:39 CEST 2015


Hi Justin,
Welcome back. Thanks I solved it the other day. I got the coordinate and
topology.
Cheers
James

On Monday, July 27, 2015, Justin Lemkul <jalemkul at vt.edu> wrote:

>
>
> On 7/24/15 4:16 AM, James Lord wrote:
>
>> Hi all,
>> I want to make the the hydrophobic layer Justin has made but only have one
>> .itp file from ATB for the hydrophobic layer (no topology and coordinate)?
>> Any suggestion where and how to start to make this  hydrophobic layer? I
>> am
>> aware of what Justin has suggested regarding using PRODRG
>> <http://davapc1.bioch.dundee.ac.uk/cgi-bin/prodrg>,. any comments?
>>
>
> I really don't understand what you're asking.  Can you explain your
> intended process in more detail?
>
> -Justin
>
> --
> ==================================================
>
> Justin A. Lemkul, Ph.D.
> Ruth L. Kirschstein NRSA Postdoctoral Fellow
>
> Department of Pharmaceutical Sciences
> School of Pharmacy
> Health Sciences Facility II, Room 629
> University of Maryland, Baltimore
> 20 Penn St.
> Baltimore, MD 21201
>
> jalemkul at outerbanks.umaryland.edu | (410) 706-7441
> http://mackerell.umaryland.edu/~jalemkul
>
> ==================================================
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
> * For (un)subscribe requests visit
> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> send a mail to gmx-users-request at gromacs.org.
>


More information about the gromacs.org_gmx-users mailing list