Hello,
I am running *MMGBSA* on our local cluster. I am confused with one of the
commands.
Sometimes "*source /etc/profile.d/modules.sh*" works, sometimes I got error
"ImportError: Could not import Amber Python modules. Please make sure you
have sourced /cm/shared/apps/amber16/amber.sh (if you are using
sh/ksh/bash/zsh) or /cm/shared/apps/amber16/amber.csh (if you are using
csh/tcsh)"
So I used this command line to "*source /cm/shared/apps/amber16/amber.sh*"
and it works.
May I ask what's the difference between these two commands? Which one
should I use?
Best regards,
Rui
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Received on Mon Dec 16 2019 - 16:30:02 PST
