Dear all,
I want to use g_rotacf to calculate the order parameter(S2, N-H bond in
main chian).
The tool g_rotacf needs an index.ndx file that contains two vectors. How can I
make the
index.ndx file? Can I use the tool make_ndx to do this? Or I need to write the
file manually?
Best regards,
2009-1-4
=========================================
Dechang Li, PhD Candidate
Department of Engineering Mechanics
Tsinghua University
Beijing 100084
PR China
Tel: +86-10-62773779(O)
Email: [email protected]
=========================================
_______________________________________________
gmx-users mailing list [email protected]
http://www.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at http://www.gromacs.org/search before posting!
Please don't post (un)subscribe requests to the list. Use the
www interface or send it to [email protected].
Can't post? Read http://www.gromacs.org/mailing_lists/users.php
