Dear gmx users,
In my previous mail, please read eigen vectors as eigen values.
The command used was
$echo 3 | g_polystat -s md0-1.tpr -f traj.xtc -b 50 -n poly.ndx -o 3.xvg
I am using v4.6.3.
Sorry for the misleading information.
Thanks
On Thu, Jul 3, 2014 at 2:35 AM, Chandan Choudhury
Dear gmx users,
The g_polystat tool arranges the Rg eigen vectors in the descending order.
We cannot see how a particular eigen vector (one along the X-axis) varies
with time. We can obviously comment the section of the g_polystat code to
avoid the sorting. Is there a reason, why do we sort the
