[gmx-users] g_dist problems
Edvin Erdtman
edvin.erdtman at nat.oru.se
Tue May 22 14:53:50 CEST 2007
Hi
I am doing MD-calculations on double layer lipid membranes. When I
wanted to calculate the distance between the com. of the lipids and my
molecule with g_dist, the program just stops! Sometimes directly and
sometimes after a couple of picoseconds. When checking the output it can
end like this:
216.0000153 3.7262651 2.1282473 1.1397220 -2.8384237
216.5000153 3.7
Am I doing something wrong? I tried to convert the trajectory using
trjconv -pbc, but non of the options seems to work.
Edvin
--
Edvin Erdtman Ph.D. student
Department of Natural Sciences
and Örebro Life Science Center
Örebro University
701 82 Örebro, Sweden
phone: +46 (0)19 30 36 69
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