[gmx-users] g_hbond
simon sham
ssham44 at yahoo.com
Thu Jun 16 17:39:03 CEST 2011
Hi,
I am little confused about setting up the two groups in g_hbond.
1. Are the two groups corresponding to the donor (N) and the acceptor (O) atoms?
I want to measure the lifetime, angle and distance of the triplet N-H....O hydrogen bond. Is this the triplet that the manual talks about?
Thanks for your insight.
Simon
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20110616/7532aa88/attachment.html>
More information about the gromacs.org_gmx-users
mailing list