There's a question in installing AmberTools16 separately !
Is it necessary to export AMBERHOME again for amber16?
Or export AMBERHOME=$AMBERHOME=/opt/amber14
Best regards
On Sat, 11/26/2016 08:52 PM, David A Case <david.case.rutgers.edu> wrote:
> On Sat, Nov 26, 2016, Mohaddeseh Habibzadeh wrote:
>
> > I'm installing Amber14 with Ambertools16.
>
> You can't do this in any direct way: AmberTools16 should be extracted into a
> directory tree headed by "amber16"; Amber14 needs to be in a directory tree
> headed by "amber14".
>
> If you are unable to upgrade to Amber16, use AmberTools16 for everything
> except pmemd, and use Amber14 for pmemd. I don't think there should be any
> problems with that combination.
>
> ....dac
>
>
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Received on Sat Nov 26 2016 - 23:30:02 PST
