List of the molecular dynamics simulations performed in this work.
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For each mutation type, columns two and three describe the MD simulations that were performed to extract free energy differences. SGTI refers to slow growth thermodynamic integration method, see SI material methods. In columns four and five we list all the MD simulations that were carried out to characterize the effect of such mutation in terms of structural and energetic variations.
创建时间：
2015-12-02
