On Mon, Feb 5, 2018 at 9:14 AM, roja rahmani <roja.rhmn.gmail.com> wrote:
> yes, i don't have amber.python in bin directory.
>
Then you need to just use "python". But make sure you source
$AMBERHOME/amber.sh first, because the first error message you got
suggested that you did not have the ParmEd python packages in the searched
Python path:
source $AMBERHOME/amber.sh
python script.py
HTH,
Jason
--
Jason M. Swails
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Received on Mon Feb 05 2018 - 06:30:12 PST
