[gmx-users] Fwd: -pbc nojump
leila karami
karami.leila1 at gmail.com
Wed Oct 27 10:05:18 CEST 2010
Hi Carsten
Thanks for your answer. You got my case very well.
I understand your mean as follows:
1) Trjconv –f a.xtc –s a.tpr –o b.xtc –pbc mol (output group=water)
2) Trjconv –f a.xtc –s a.tpr –o c.xtc –pbc nojump (output group
=protein-dna)
Is that true?
You said, (Then overlay both results in the visualization program). How?
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20101027/279232b7/attachment.html>
More information about the gromacs.org_gmx-users
mailing list