[gmx-users] converting gromacs topology file to namd topology file

John Whittaker johnwhittake at zedat.fu-berlin.de
Thu Apr 2 15:19:23 CEST 2020


Hi,

A quick google search led me to this:

https://www.ks.uiuc.edu/Research/namd/2.10/ug/node14.html

I've never used NAMD before but apparently you can use gromacs topologies
directly in NAMD. Note the caveats at the bottom of the page.

Would this work or does it not accomplish what you are looking for?

- John

> Hello Dear Gromacs 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
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
> * For (un)subscribe requests visit
> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send
> a mail to gmx-users-request at gromacs.org.
>




More information about the gromacs.org_gmx-users mailing list