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Binding thermodynamics and interaction patterns of human purine nucleoside phosphorylase-inhibitor complexes from extensive free energy calculations |
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| Authors: | Huai Zhe Yang Huaiyu Sun Zhaoxi |
| Institution: | 1.State Key Laboratory of Precision Spectroscopy, School of Physics and Electronic Science, East China Normal University, Shanghai, 200062, China ;2.College of Engineering, Hebei Normal University, Shijiazhuang, 050024, China ; |
| Abstract: | Journal of Computer-Aided Molecular Design - Human purine nucleoside phosphorylase (hPNP) plays a significant role in the catabolism of deoxyguanosine. The trimeric protein is an important target... |
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