Peilu Song

Chiral separation of 12 pairs of enantiomers by capillary electrophoresis using heptakis‐(2,3‐diacetyl‐6‐sulfato)‐β‐cyclodextrin as the chiral selector and the elucidation of the chiral recognition mechanism by computational methods

Yaqi Yao, Peilu Song, Miaoduo Deng et al. · Journal of Separation Science · 2017 · 32 citations

Pharmacy, Pharmaceutical Analysis, Pharmacology +17

Molecular dynamics simulation and QM/MM calculation reveal the selectivity mechanism of type I 1/2 kinase inhibitors: the effect of intramolecular H-bonds and conformational restriction for improved selectivity

Hanxun Wang, Zisen Gao, Peilu Song et al. · Physical Chemistry Chemical Physics · 2019 · 32 citations

Pharmacy, Medicinal Chemistry, Pharmacology +17

Synthesis of selective PAK4 inhibitors for lung metastasis of lung cancer and melanoma cells

Peilu Song, Fan Zhao, Dahong Li et al. · Acta Pharmaceutica Sinica B · 2022 · 25 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +13

Precise design of highly isoform-selective p21-activated kinase 4 inhibitors: computational insights into the selectivity mechanism through molecular dynamics simulation and binding free energy calculation

Yuan Su, Peilu Song, Hanxun Wang et al. · Journal of Biomolecular Structure and Dynamics · 2019 · 14 citations

Life Sciences, Molecular Biology, Pharmacology +17

Strategy and validation of a structure-based method for the discovery of selective inhibitors of PAK isoforms and the evaluation of their anti-cancer activity

Peilu Song, Gang Wang, Yuan Su et al. · Bioorganic Chemistry · 2019 · 13 citations

Pharmacy, Medicinal Chemistry, Pharmacology +14