[gmx-users] where is the script?

Hello: I found that someone mentioned that there is a script from Mark which could be used to convert CGenff format into Gromacs .itp file. I searched the mailist and didn't find it. I am just wondering where can I obtain this script? thank you very much best Albert -- gmx-users mailing

Re: [gmx-users] where is the script?

On 2012-11-26 12:00, Albert wrote: Hello: I found that someone mentioned that there is a script from Mark which could be used to convert CGenff format into Gromacs .itp file. I searched the mailist and didn't find it. I am just wondering where can I obtain this script? thank you very much

Re: [gmx-users] where is the script?

On 11/26/2012 02:36 PM, David van der Spoel wrote: It's posted on the website. http://www.gromacs.org/Downloads/User_contributions/Other_software You want this one:charmm2gromacs-pvm.py -- thanks a lot for kind reply. But how to use it? I am trying to run with command: python