System details for molecular dynamics simulations performed in this study.*
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*All ten simulations were in addition performed independently at T = 300, 350, and 400 K, giving a total of 30 simulations of 10 ns NPT ensemble +3 ns NVT ensemble.†Background ionic concentration based on total cell volume.‡Background ionic concentration based on water volume.
创建时间:
2015-12-02



