[gmx-developers] The do_update_sd2 function for Langevin dynamics

Mark Abraham mark.j.abraham at gmail.com
Tue Dec 10 00:09:30 CET 2013


Thanks for the interest - I guess nobody who knows has the time right now
to look into it. Perhaps you could try the change you suggest on a toy
system and see for yourself which version of the integrator samples
appropriately, and report back?


On Mon, Dec 9, 2013 at 7:56 PM, huapingli <lihuaping at tju.edu.cn> wrote:

> Is there anybody noticing this quention?
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