[gmx-users] calculation of chemical shift anisotropy

[Moutusi Manna]

Dear all,

            I
have simulated a small peptide on lipid-water interface under NPT
condition. Is it possible to calculate the chemical shift anisotropy of
the peptide from the simulation trajectory?


Moutusi Manna



      The INTERNET now has a personality. YOURS! See your Yahoo! Homepage. http://in.yahoo.com/
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20091222/6fcdc44a/attachment.html>