"start_pref_f" not support on DeepMD-kit v2.0.1 gpu cuda 11.3 #1197
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Franklalalala
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This is a bug in both cpu and gpu version. plz check if you really use v2.0.1 cpu. I create an issue from this discussion. |
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I saw this feature in the code, loss function, which is exactly what i'm looking for. Since my data is not from md trajectory, most of the atoms have a extremely low force. Apply this "atom prefernce" feature may greatly improve the force prediction.
I've seen this.
#358
And checked my data with this
#709
I've tried this feature on my cpu version, the results looks acceptable. However, I can't run it with GPU version. BUG is: ArgumentKeyError: [at location
loss
] undefined keystart_pref_pf
is not allowed in strict mode.What can i do to implement this feature with GPU? Lower my version? If so, which version? Thanks!
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