[gmx-users] pick in pull.xvg
ramezanpour.mohsen at gmail.com
Sat Mar 19 12:47:42 CET 2011
I did a pulling simulation for protein-drug system.
My output (pull.xvg) has a pick in 100 ps (equivalent to 1 nm),
the rest of plot is flat(of course with oscilation around the average),of
course with NOT ZERO average in the flat region.
Can I result ?
" the interaction between protein and drug has finished after 1 nm"
If yes, why the average of flat region is not zero(after the pick)?
Thanks in advance
-------------- next part --------------
An HTML attachment was scrubbed...
More information about the gromacs.org_gmx-users