[gmx-users] (no subject)

Maria Nemirovskaya nemirovm at darkwing.uoregon.edu
Wed Oct 29 02:33:01 CET 2003


I am using sd for my simulations and have a question about it. Could
someone explain to me why the kinetic energy is corrected for the
friction and where the form of the correction (i.e. exp(-e
delt)+sqrt(2)(1-exp(-e delt)) comes from?

Thanks a lot,


Maria Nemirovskaya
Postdoctoral Research Associate
Dept. of Chemistry, University of Oregon

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