[gmx-users] problem with generating itp file for my own ligand

Mark Abraham Mark.Abraham at anu.edu.au
Tue Dec 25 14:48:51 CET 2007

Lam Yan, Sonia wrote:
> Hi everyone!
> I know there are some programs/servers such as PRODRG which can help us 
> to generate the itp files for specific ligand.
> However, the system now I am working on is Gromacs OPLSAA, I wonder if 
> there are other programs besides PRODRG which
> can generate the topology/itp files of my ligand in all-atom system?
> And the ligand I am working with is acetyl-phosphate.

There's some good advice here... 


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