[gmx-users] Problem with g_density
prithvi raj pandey
pandeyprithviraj at gmail.com
Thu Apr 8 16:45:56 CEST 2010
Dear gmx-users,
I have generated 40ns trajectories for DPPC bilayer - water system. The
whole 40ns was generated in small trajectories and finally I concatenated
all the small trajectories to a big 40 ns trajectory using the following
options in trjcat
trjcat -f -o -settime -tu
Now the problem is when I am trying to plot partial density along the
bilayer - water interface axis (i.e. Z) using the big trajectory for
different groups (e.g., water,DPPC etc.), density for water comes around 150
kg/m^3. But for any of the small trajectories the value is ok (i.e. around
1000). The plots were done using the folloing tool
g_density -f -o -n -s -d Z
Can anyone help?
--
Prithvi Raj Pandey
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20100408/cb3fc056/attachment.html>
More information about the gromacs.org_gmx-users
mailing list