Carla Jamous wrote:
Hi everyone,
I used g_sas: g_sas -s .tpr -f .xtc -n .ndx -o .xvg -or resarea.xvg
What I don't understand is why there are 3 columns in the file
resarea.xvg although this is what's written in my file:
# g_sas is part of G R O M A C S:
#
# GROtesk MACabre and Sinister
#
@ title "Area per residue"
@ xaxis label "Residue"
@ yaxis label "Area (nm\S2\N)"
@TYPE xy
So I would expect this file to contain only two columns. I'm using
gromacs version 4.0.3.
Residue, average area, standard deviation.
-Justin
Thanks for your help,
Carla
--
========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
========================================
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