[gmx-users] Potential Energy = -nan

[shikha agarwal]

hi,
I m tried nstxout=1 in my  .mdp file.

Potential Energy  =           -nan
Maximum force     =  3.5637456e+07 on atom 2455
Norm of force     =           -nan


help me!


regards:

shikha
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20101227/6dbf13c6/attachment.html>