[gmx-users] The time for the temperature and pressure coupling

Bao Kai paeanball at gmail.com
Wed Feb 6 23:28:45 CET 2013


Dear Gromacs Team,

I have a small question related to the scheme of the MD in Gromacs.

When are the temperature and pressure constrains are enforced, before
the update of the velocity and position or after?

Thank you very much.

Best Regards,
Kai



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