[gmx-users] stochastic dynamics , langevin
omermar at gmail.com
Thu Oct 23 16:18:30 CEST 2008
Thanks for the quick reply Berk.
> 1) Is this the proper keywords I should use for Langevin dynamics:
> integrator = sd ;
> bd-fric = 0 ;
> tau_t = 10 ;
> ref_t = 300 ;
Basically, I want to know if I am using the 4 parameters correctly.
That is - for Langevin dynamics, I should pick bd-fric=0, to allow the
friction to be taken from 1/tau_t ?
Secondly, I am looking for examples of tau_t different people use for
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