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Published 20 hours ago • verified publisher icon PaddlePaddle

Result

Open Benstime opened this issue 2 years ago • 1 comments

Why the result of D-MPNN in the table of your paper is different from https://github.com/chemprop/chemprop.

Benstime avatar Mar 09 '22 09:03 Benstime

Hi, Benstime, thanks for asking. The reason might be the result table in our paper are using the scaffold split to split the train/valid/test set of the dataset, and the original D-MPNN are using the random split. Hope this can he helpful to you.

Noisyntrain avatar Mar 13 '22 06:03 Noisyntrain