[gmx-users] Average crystallographic angles for a triclinic box
Justin Lemkul
jalemkul at vt.edu
Wed Nov 21 00:30:44 CET 2018
On 11/20/18 12:02 PM, Lakshman Ji Verma wrote:
> Thanks, Justin,
> Is there any tool in Gromacs which can give the average box angles?
> g_energy only give dimensions in terms matrix parameters but not in terms
> of box angles.
Maybe gmx traj -ob?
-Justin
--
==================================================
Justin A. Lemkul, Ph.D.
Assistant Professor
Office: 301 Fralin Hall
Lab: 303 Engel Hall
Virginia Tech Department of Biochemistry
340 West Campus Dr.
Blacksburg, VA 24061
jalemkul at vt.edu | (540) 231-3129
http://www.thelemkullab.com
==================================================
More information about the gromacs.org_gmx-users
mailing list