[gmx-users] g_rdf

Rama Gullapalli quantrum75 at yahoo.com
Tue Nov 7 20:36:32 CET 2006

Hi GMX ers,
  I posted this question earlier, but did not receive a reply. Hope to get an answer this time around.
  I was wondering what could be the origin of a spike at close distances  when I compute the RDF of  N-P atoms  in a lipid bilayer  system (<0.25 nm) I tried using -cut option and also increasing the  nrexcl to 5 in the N and P atoms ( to avoid intramolecular  contributions?)
  And yet, I still get that spike.
  Any insight would be very helpful
Everyone is raving about the all-new Yahoo! Mail.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20061107/bdad2b42/attachment.html>

More information about the gromacs.org_gmx-users mailing list