Re: converting gromacs topology file to namd

From: Josh Vermaas (joshua.vermaas_at_gmail.com)
Date: Wed Apr 01 2020 - 18:21:55 CDT

• Next message: Francesco Pietra: "Re: QMMM param issue"
• Previous message: Hadi Rahmaninejad: "converting gromacs topology file to namd"
• In reply to: Hadi Rahmaninejad: "converting gromacs topology file to namd"
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]

You can try parmed. https://parmed.github.io/ParmEd/html/index.html

In general though, .itp files are a royal mess for anything else to read
because of their dangerous include logic.
-Josh

On Wed, Apr 1, 2020 at 4:46 PM Hadi Rahmaninejad <ha.rahmaani_at_gmail.com>
wrote:

> Hello Namd users,
>
> I hope this email finds you well. I am sending this email to ask is there
> any way I can convert gromacs topology file (.itp) to namd (top) file? I
> appreciate any help,
>
> Best regards,
> Hadi
>

• Next message: Francesco Pietra: "Re: QMMM param issue"
• Previous message: Hadi Rahmaninejad: "converting gromacs topology file to namd"
• In reply to: Hadi Rahmaninejad: "converting gromacs topology file to namd"
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]

This archive was generated by hypermail 2.1.6 : Fri Dec 31 2021 - 23:17:08 CST