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. 2022 Nov;36(5-6):587–602. doi: 10.1177/10943420221121804

Table 1.

Validation accuracy for pre-training runs with WordPiece tokenizer.

Nodes Molecules Batch size Accuracy
1 2.4 · 106 1.4 · 103 0.760
10 2.4 · 107 1.4 · 104 0.783
100 2.4 · 108 1.4 · 105 0.797
1000 2.4 · 109 1.4 · 106 0.798
1008 9.6 · 109 1.5 · 106 0.808
4032 9.6 · 109 5.8 · 106 0.801