15 lines
231 B
Plaintext
15 lines
231 B
Plaintext
file_format extxyz
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file_extension xyz
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path_to_training_data_set "XYZ"
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path_to_test_data_set "XYZ"
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fitting_weight_energy 100.0
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fitting_weight_force 1.0
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error_analysis_for_training_data_set 1
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error_analysis_for_test_data_set 0
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