Hello,
I am do MD for a large solvated system in PBC. After analysised the
trajectories, I found that the part of the system move to another site
of the box due to the PDC. I remember there were a discussion before,
but I can not find it in my deposited emails and the amber website.
Could anyone tell me how to correct this results? I mean keep recover
the system as a whole.
thanks,
Jianxin
Received on Mon Oct 25 1999 - 17:53:25 PDT