On 10/12/16 1:16 PM, Nikhil Maroli wrote:
I have a nanotube embed perpendicular to the lipid bilayer , I would like
to observe is there any changes in the orientation of tube with respect to
initial position (the deviation from the perpendicular position/time)
during the simulation . Can I find any gromacs tools for the same ?
I'm not sure the possibilities of gmx angle becuase of - It should be
noted that the index file must contain atom triplets for angles or atom
quadruplets for dihedrals. If this is not the case, the program will crash.
You want gmx gangle -g1 angle -g2 z
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
jalem...@outerbanks.umaryland.edu | (410) 706-7441
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