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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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Bibliographic Details
Title: Binding thermodynamics and interaction patterns of human purine nucleoside phosphorylase-inhibitor complexes from extensive free energy calculations.
Authors: Huai, Zhe1, Yang, Huaiyu2, Sun, Zhaoxi1, z.sun@pku.edu.cn
Source: Journal of Computer-Aided Molecular Design; May2021, Vol. 35 Issue 5, p643-656, 14p
Database: Applied Science & Technology Source
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