Calculating the Binding Entropy of Host-Guest Systems with Physics-Guided Neural Networks

Alles Rebel, Ali Risheh, Negin Massoudian, Negin Forouzesh. Calculating the Binding Entropy of Host-Guest Systems with Physics-Guided Neural Networks. In Donald A. Adjeroh, Qi Long, Xinghua Mindy Shi, Fei Guo, Xiaohua Hu, Srinivas Aluru, Giri Narasimhan, Jianxin Wang, Mingon Kang, Ananda Mondal, Jin Liu, editors, IEEE International Conference on Bioinformatics and Biomedicine, BIBM 2022, Las Vegas, NV, USA, December 6-8, 2022. pages 3478-3485, IEEE, 2022. [doi]

Abstract

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