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Molecular  dynamicsÖÐÎÒÓÃÁËstochastic boundary£¬µ«ÊÇͶÎÄÕÂÖÐÎÒ¿ÉÒÔÃèÊö³ÉÕâÑùô
The stochastic boundary condition were applied during the molecular dynamic simulation
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Finally, a 10 ns simulation using the canonical NVT ensemble at 300 K was performed
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