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Training hyperparameters #1

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kavi9030 opened this issue May 20, 2024 · 0 comments
Open

Training hyperparameters #1

kavi9030 opened this issue May 20, 2024 · 0 comments

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@kavi9030
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kavi9030 commented May 20, 2024 •
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Hello,
I noticed that you've recently updated the training scripts for the mace-off models.
I have a questions on the hyperparameters that were used.

  1. May I know how the coefficients were determined:
    forces_weight=1000
    energy_weight=40
  2. max_num_epochs was set to 190. Is that correct? Was the model initiated with random weights and biases or from a pre-trained model?

Thank you in advance.
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