[gmx-users] Amber to Gromacs conversion

Barnett, James W. jbarnet4 at tulane.edu
Tue Dec 3 19:16:52 CET 2013


On 12/03/2013 11:45 AM, Chetan Mahajan wrote:
> are there other tools to convert Amber input files
> into the ones for Gromacs?

I've had success with acpype:
https://code.google.com/p/acpype/

Use the "amb2gmx" mode:

acpype -p _prmtop_ -x _inpcrd_

-- 
Wes Barnett | jbarnet4 at tulane.edu


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