maleki.afsaneh at gmail.com
Thu Mar 15 16:59:38 CET 2012
Hello dear user,
I have a system that is contained protein-water-ions. I used the
g_sas -f free.xtc -s free.tpr -o area -or res_area -oa
atom_area –q -nopbc
I select the whole protein first for calculation, and then this protein
for output.In this way I can obtain Area per residue from "res_area" file and
area per atom from "atom_area" file.
How to get area per residue with data of area per atom from "atom_area"
file? When I average on area per atoms for a selected residue, it
doesn't correspond with area per residue for a selected residue from
How to correlate area per residue for a selected residue with area per
atoms for a selected residue?
Thanks in advance,
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