On Thu, Oct 24, 2013 at 6:55 AM, marco.molinari <m.molinari.bath.ac.uk>wrote:
> Good Morning,
>
> I am new to AMBERTOOLS and I just installed the latest version of
> AMBERTOOLS (AmberTools13).
> I compiled only AMBERTOOLS13 without problems. However 2 tests
> (01_Generalized_Born and 03_Alanine_Scanning) resulted in an error.
>
> Hereafter you will find part of the *.log and the mmpbsa.out for
> 03_Alanine_Scanning (the problem seems to be the same for
> 01_Generalized_Born).
>
> Any suggestions would be appreciated.
>
Thanks for the report! I have fixed this issue. Please update your
AmberTools installation. (If you just updated, you can save some time by
running the commands:
cd $AMBERHOME && ./update_amber --update
make -C AmberTools/src/mmpbsa_py install
). Then try again. It should work.
Thanks again,
Jason
--
Jason M. Swails
BioMaPS,
Rutgers University
Postdoctoral Researcher
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Thu Oct 24 2013 - 05:30:02 PDT
