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Computational investigation of 4,5-diphenyl-1H-pyrrole-3-carboxylic acid derivatives as B-cell lymphoma-extra large (Bcl-xL) inhibitors by using 3D-QSAR,molecular docking,and molecular dynamics simulations |
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| Authors: | Zhang Heng Gu Xi Meng Churen Zhou Di Chen Gang Wang Jian Liu Yang Li Ning |
| Affiliation: | 1.School of Traditional Chinese Materia Medica, Shenyang Pharmaceutical University, Wenhua Road 103, Shenyang, 110016, People’s Republic of China ;2.School of Pharmaceutical Engineering, Shenyang Pharmaceutical University, Shenyang, 110016, People’s Republic of China ; |
| Abstract: | Structural Chemistry - B-cell lymphoma-extra large (Bcl-xL) can inhibit apoptosis via heterodimerization with pro-apoptotic Bcl-2 family proteins, and is over-expressed in many different types of... |
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