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PEMP: Leveraging Physics Properties to Enhance Molecular Property Prediction

PEMP: Leveraging Physics Properties to Enhance Molecular Property Prediction

Molecular property prediction is essential for drug discovery. In recent years, deep learning methods have been introduced to this area and achieved state-of-the-art performances. However, most of existing methods ignore the intrinsic relations between molecular properties which can be utilized to improve the performances of corresponding prediction tasks. In this …