Author

Heng Cai

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#machine learning Aug 2025

CarsiDock-Cov: A deep learning-guided approach for automated covalent docking and screening

CarsiDock-Cov is presented, a new paradigm distinguishing itself as the first deep learning (DL)-guided approach for covalent docking, offering an automated and efficient solution that shows considerable promise for accelerating covalent drug discovery and design.

Chao Shen, Hongyan Du, Xujun Zhang et al. · Acta Pharmaceutica Sinica B · 12 citations