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The restraint-free 0.3 s production dynamics runs were carried out for each system with a time step of 2 fs in the isothermalisobaric ensemble (constant pressuretemperature, NPT) at 310 K and 1 bar pressure using the Nos-Hoover thermostat
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The position of the water bottle was alternated daily between sides to avoid the development of a side preference
Once established, maintain consistency in your routine, as this helps ensure stable medication levels and optimal therapeutic effects
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