[gmx-users] a question related to the extending of md

[Acoot Brett]

   Dear All,
 
I am raning the 100 ps npt according to the on-line tutorial. For the computer reason it stops at about  less than50 ps.
 
Then I$ tpbconv -s npt.tpr  -until 100 -o 100npt.tpr
 
 mdrun -s 100npt.tpr -cpi npt.cpt -v
 
After completes I analyzee the g-energy. But xgrace shows for pressure and dnsity, the x-axis is only from 0 to a little more than 50 ps, and I cannot get the results for x-axis from 0 to 100 ps.
 
I am looking forward to getting a reply from you on how to solve the probelm.
 
Cheers,
 
Acoot
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20120402/8b0a2b9d/attachment.html>