Multi-PLI: interpretable multi‐task deep learning model for unifying protein–ligand interaction datasets

Multi-PLI: interpretable multi‐task deep learning model for unifying protein–ligand interaction datasets

Abstract The assessment of protein–ligand interactions is critical at early stage of drug discovery. Computational approaches for efficiently predicting such interactions facilitate drug development. Recently, methods based on deep learning, including structure- and sequence-based models, have achie...

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Bibliographic Details
Main Authors: Fan Hu, Jiaxin Jiang, Dongqi Wang, Muchun Zhu, Peng Yin
Format: Article
Language:English
Published: BMC 2021-04-01
Series:Journal of Cheminformatics
Subjects:
Interpretable
Deep learning
Multi‐task
Drug discovery
Online Access:https://doi.org/10.1186/s13321-021-00510-6

Internet

https://doi.org/10.1186/s13321-021-00510-6

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