[gmx-users] Restrict rotation between 2 molecules

Amir Marcovitz amarcovitz at gmail.com
Mon Jan 25 18:07:16 CET 2010


i want to simulate 2 parallel plates (each composed of single atoms with
equal spacing , for example 2X2 atoms plate)
i want to simulate them such that they are parallel to each other and can
move only along one axis (for that i used posre.itp..)

what is the best best way to prevent them from rotating with respect to each

i tried to define improper angles between atoms on the surfaces, do you
think it is a good strategy?

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20100125/6e2148a9/attachment.html>

More information about the gromacs.org_gmx-users mailing list