[gmx-users] determining of Kn and Posn in Umbrella sampling

Farzad Molani farzad_c81 at yahoo.com
Sun Dec 16 07:39:34 CET 2007


Hi dear
I want to compute PMF between two amine molecoules by umbrella sampling but I do'nt know Kn and Posn in umbrella samplig how are determining.
if you are having points please help me.
Thanks in advance

       
---------------------------------
Be a better friend, newshound, and know-it-all with Yahoo! Mobile.  Try it now.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20071215/e53c1406/attachment.html>


More information about the gromacs.org_gmx-users mailing list