Calculation of Protein-Ligand Binding Free Energy Using a Physics-Guided Neural Network

Sahar Cain, Ali Risheh, Negin Forouzesh. Calculation of Protein-Ligand Binding Free Energy Using a Physics-Guided Neural Network. In Yufei Huang, Lukasz A. Kurgan, Feng Luo, Xiaohua Hu, Yidong Chen, Edward R. Dougherty, Andrzej Kloczkowski, Yaohang Li, editors, IEEE International Conference on Bioinformatics and Biomedicine, BIBM 2021, Houston, TX, USA, December 9-12, 2021. pages 2487-2493, IEEE, 2021. [doi]

Abstract

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