[gmx-users] Temperature in Non-equilibrium MD simulation.

Ho, Tuan A. tuanho at ou.edu
Wed Apr 1 12:31:58 CEST 2015

Dear all,

As far as I understand GROMACS did NOT exclude the streaming velocity (Poisseuille flow) from the temperature calculation and I think it is not correct. I was wondering if someone has modified Gromacs code to obtain a good thermostat. Please let me know. Thank you very much.


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