Preprocessed datasets and model weights for RXNGraphormer

This repository provides: 1. Preprocessed reaction datasets for RXNGraphormer pretraining 2. Preprocessed fine-tuning datasets for downstream tasks 3. Pretrained model weights (base & fine-tuned variants) There is a "readme.md" file in every dataset's zip file, which describes how...

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Bibliographic Details
Main Author: Li-Cheng Xu (20693692) (author)
Other Authors: Miao-jiong Tang (19654116) (author), Junyi An (20696436) (author), Fenglei Cao (20693689) (author), Yuan Qi (20693691) (author)
Published: 2025
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