"Using Gaussian accelerated molecular dynamics combined with Markov state ..."

Fangfang Guo et al. (2024)

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DOI: 10.1016/J.COMPBIOMED.2024.108598

access: closed

type: Journal Article

metadata version: 2024-07-19

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Fangfang Guo, Hengzheng Yang, Shihong Li, Yongxin Jiang, Xue Bai, Chengxiang Hu, Wannan Li, Weiwei Han:
Using Gaussian accelerated molecular dynamics combined with Markov state models to explore the mechanism of action of new oral inhibitors on Complex I. Comput. Biol. Medicine 177: 108598 (2024)

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