MES-physics
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MES-physics
I also tried this code, plot_errorvsdistance.py, and got this error: Please help. I expect the line with 'forces' will fail next too. Traceback (most recent call last): File "/home/m/GPUMDcalc/NEPdata/./errorvsdistance.sh", line...
I got plot_select_structure.py to run and produce a plot. It also produces a file 'selected.traj', but that is a binary file. If I want to use this for active learning/retraining...