Hi All,
I successfully installed the serial version of Amber20 . When I try to test the cuda serial version, I got the below error message.
sudo ./test_amber_cuda_serial.sh
Error: Could not import Amber Python modules!
Probably your Amber Python environment was not set up correctly.
We recommend adding the line:
test -f /data/Amber/amber20/amber.sh && source /data/Amber/amber20/amber.sh (sh/bash/zsh)
or
test -f /data/Amber/amber20/amber.csh && source /data/Amber/amber20/amber.csh (csh/tcsh)
to your login shell resource file (e.g., ~/.bashrc or ~/.cshrc).
I included either one lines in the bashrc file and try to test it. But not succeed
export PYTHONPATH=$AMBERHOME/lib/python3.9/site-packages
export PYTHONPATH=$AMBERHOME/lib/python3.9/site-packages:$PYTHONPATH
Regards
Suguna
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Received on Thu Feb 03 2022 - 18:00:02 PST
