高活性和高选择性的PDE5抑制剂的合理化设计
序号 | 标题 | 类型 | 作者 |
---|---|---|---|
1 | Theoretical calculation of the binding free energies for pyruvate dehydrogenase E1 binding with ligands | 期刊论文 | Y. Li|C. G. Zhan|Y. Xiong|H. He| |
2 | First-principles determination of molecular conformations of cyclic adenosine 3',5'-monophosphate in gas phase and aqueous solution | 期刊论文 | C. G. Zhan|X. Chen| |
3 | 磷酸二酯酶2(PDE2)结构及其选择性抑制剂的研究进展 | 期刊论文 | 陈喜|湛昌国|赵新筠| |
4 | Computational determination of fundamental pathway and activation barriers for acetohydroxyacid synthase-catalyzed condensation reactions of alpha-keto acids | 期刊论文 | J. Liu|C. G. Zhan|Y. Xiong|G. F. Yang| |
5 | Dynamic structures of phosphodiesterase-5 active site by combined molecular dynamics simulations and hybrid quantum mechanical/molecular mechanical calculations | 期刊论文 | C. G. Zhan|H. T. Lu|Y. Xiong| |