[gmx-users] bouncing molecules
Nuno R. L. Ferreira
nunolf at ci.uc.pt
Tue Dec 23 16:03:01 CET 2003
Right.
It displays the "periodical conditions" given the coordinates of the box.
----- Original Message -----
From: Dallas Warren
To: gmx-users at gromacs.org
Sent: Tuesday, December 23, 2003 12:18 AM
Subject: Re: [gmx-users] bouncing molecules
P.S. If you want to see the trajectory in VMD without those molecules moving
from one side of the box to the other, you can use trjconv and the
flags -pbc and -ur. Check gmx e-mail list, think this issue was already
asked by someone.
VMD also now supports displaying the box on each face of itself.
Catch ya,
Dr. Dallas Warren
Research Fellow
Department of Pharmaceutical Biology and Pharmacology
Victorian College of Pharmacy, Monash University
381 Royal Parade, Parkville VIC 3010
dallas.warren at vcp.monash.edu.au
+61 3 9903 9083
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When the only tool you own is a hammer, every problem begins to resemble a nail.
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