[gmx-users] Software to generate polymer coordinates

Dallas Warren Dallas.Warren at monash.edu
Wed Aug 18 02:24:47 CEST 2010


I have been searching for awhile now trying to find a script / software
package that will generate the coordinates of a polymer.  There are some
that will repeat a simple unit and there is an online one that will
allow you to generate some, but you can only use their predefined
monomers (http://wwmm-svc.ch.cam.ac.uk/polydemo/).

What I am after is something that you can specify your own monomer
units, how they link together, able to handle more than one monomer,
manner in which monomers are bonded (alternating, periodic, statistical,
block) and may be even grafts.

Has anyone found or know of one that can do anything like this?

Catch ya,

Dr. Dallas Warren
Drug Delivery, Disposition and Dynamics
Monash Institute of Pharmaceutical Sciences, Monash University
381 Royal Parade, Parkville VIC 3010
dallas.warren at pharm.monash.edu.au
+61 3 9903 9167
---------------------------------
When the only tool you own is a hammer, every problem begins to resemble
a nail.



More information about the gromacs.org_gmx-users mailing list