[gmx-users] Using make_ndx to combine many residues into 1 group

Justin Lemkul jalemkul at vt.edu
Tue Feb 16 19:59:07 CET 2016



On 2/16/16 1:57 PM, Agnivo Gosai wrote:
> Dear Users,
>
> I have used make_ndx to combine several residues into a group before like "
> r 120 | r 150 | r 160 "...
>
> However now I need to combine residues from r 1 to r 166 ( all of them ) to
> create a group. Is there any short cut to this using make_ndx or do I need
> to write a python or shell script ?
>
>

r 1-166

-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

==================================================


More information about the gromacs.org_gmx-users mailing list