Assessing the performance of three resveratrol in binding with SIRT1 by molecular dynamics simulation and MM/GBSA methods: the weakest binding of resveratrol 3 to SIRT1 triggers a possibility of dissociation from its binding site

Han Chen, Yan Wang, Zheng Gao, Wen Yang, Jian Gao 0004. Assessing the performance of three resveratrol in binding with SIRT1 by molecular dynamics simulation and MM/GBSA methods: the weakest binding of resveratrol 3 to SIRT1 triggers a possibility of dissociation from its binding site. Journal of Computer-Aided Molecular Design, 33(4):437-446, 2019. [doi]

Authors

Han Chen

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Yan Wang

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Zheng Gao

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Wen Yang

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Jian Gao 0004

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