[gmx-users] analysing ndx file of g_hbond
raja
raja_28 at fastmail.us
Wed Jun 28 13:29:34 CEST 2006
Dear all,
The index file produced by g_hbond listing many rows of hbonds making
atoms combination. Is there a way to get the corresponding residue and
atom name for those numbers by any of the gromacs program or if anyone
having the script to do that, kindly pass it on to me. My primary
objective is to know how many hbond listed in index file are belong to
main chain atoms.
With thanks!
B.Nataraj
--
raja
raja_28 at fastmail.us
--
http://www.fastmail.fm - The way an email service should be
More information about the gromacs.org_gmx-users
mailing list