[gmx-users] Coulomb Energies

[Saba Ferdous]

Dear Gromacs experts,

I want to ask about coulomb energies. Like if coulomb-SR and coulomb-14
show high RMSD then what should we interpret from such results??

 Average Coulomb Energy (kJ/mol)

-1.62657e+06

RMSD

2236.85

Error Estimation

150

Total drift (kJ/mol)

-894.82


Many thanks
-- 
Saba Ferdous
Research Scholar (M. Phil)
National Center for Bioinformatics
Quaid-e-Azam University, Islamabad
Pakistan
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20111217/6543cb7a/attachment.html>