[gmx-users] g_gyrate

Dallas Warren dallas.warren at vcp.monash.edu.au
Fri Sep 26 03:57:01 CEST 2003


>just periodic boundary conditions.

OK, thought that might be the other possible thing causing problems.

This pops up a bit I have noticed.  For the developers, is it possible to 
integrate support of the pbc into these scripts?  I know there are a few 
tricks to get them supporting the pbc, but have no idea if it will fit in 
with the various GROMACS scripts.   A colleague here has implemented it 
into a package of Perl scripts that he has written to manipulate various 
simulation files.

Catch ya,

Dr. Dallas Warren
Research Fellow
Department of Pharmaceutical Biology and Pharmacology
Victorian College of Pharmacy, Monash University
381 Royal Parade, Parkville VIC 3010
dallas.warren at vcp.monash.edu.au
+61 3 9903 9083
When the only tool you own is a hammer, every problem begins to resemble a nail.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20030926/c339d272/attachment.html>

More information about the gromacs.org_gmx-users mailing list