Solution-State Preorganization of Cyclic β-Hairpin Ligands Determines Binding Mechanism and Affinities for MDM2. - Yunhui Ge; Si Zhang; Mate Erdelyi; Vincent A. Voelz (J. Chem. Inf. Model., 2021)

Unexpected effect of halogenation on the water solubility of small organic compounds. - Jianfang Zhang; Kinga Virág Gulyás; Jintian Li; Minfei Ma; Liping Zhou; Leyun Wu; Ruisheng Xiong; Mate Erdelyi; Weiliang Zhu; Zhijian Xu (Comput. Biol. Medicine, 2024)