[gmx-users] how to convert CGenFF into .itp file?

Albert mailmd2011 at gmail.com
Wed Dec 26 12:29:29 CET 2012

On 12/26/2012 12:18 PM, Peter C. Lai wrote:
> You don't. CGenFF is a forcefield, like CHARMM36. You install it, add rtp
> entries then use pdb2gmx to generate a ligand's topology .itp file....

but the problem is how to use this script? I've already download the 
latest CGenFF file from CHARMM FF website....It is a folder.....

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