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within Article Remove this filter Yuzhen Niu Remove this filter Science, Humanities and Social Sciences, multidisciplinary Remove this filter Science, Humanities and Social Sciences, multidisciplinary Remove this filter

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    Revealing inhibition difference between PFI-2 enantiomers against SETD7 by molecular dynamics simulations, binding free energy calculations and unbinding pathway analysis

    SETD7 is associated with multiple diseases related signaling pathways. (R)-PFI-2 is the first SETD7 inhibitor with nanomolar inhibitory potency. The activity of (R)-PFI-2 is about 500 times over that of (S)-PF...

    Yuzhen Niu, Danfeng Shi, Lanlan Li, **gyun Guo, Huanxiang Liu… in Scientific Reports (2017)

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