[gmx-users] Polymer Simulations

Justin Lemkul jalemkul at vt.edu
Wed Mar 8 13:43:57 CET 2017



On 3/8/17 6:13 AM, NIKHIL JOSHI wrote:
> hii
>
> I am simulating polymer of 100 chains of 12 monomer repeat units. After the
> final run, if I observe the final structure in vmd, the structure is
> splitting into two. What will be the reason and how to rectify it. Please

http://www.gromacs.org/Documentation/Terminology/Periodic_Boundary_Conditions

> find the attachment.
>

The mailing list does not accept attachments.

-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

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