[gmx-users] g_tcaf

Justin Lemkul jalemkul at vt.edu
Tue Jul 29 13:54:29 CEST 2014



On 7/28/14, 10:28 PM, Andy Chao wrote:
> Dear GROMACS Users:
>
> I would like to use the g_tcaf command to compute the viscosity of ionic
> liquid.  I found out (searched online) that the g_tcaf command has some
> problems.  I used the following command

Like what?  Please provide links to the posts you're reading.

> g_tcaf -f traj.trr -s NPT.tpr -n index.ndx -oa tcaf.xvg
>
> But got error messages.  Does anybody know how to fix this problem?
>

No, because "got error messages" it a totally ambiguous statement.  Please 
provide exact information (copied and pasted errors and any other relevant output).

-Justin

-- 
==================================================

Justin A. Lemkul, Ph.D.
Ruth L. Kirschstein NRSA Postdoctoral Fellow

Department of Pharmaceutical Sciences
School of Pharmacy
Health Sciences Facility II, Room 601
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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