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 different system. Thanks, Omer.
_______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://www.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to [EMAIL PROTECTED] Can't post? Read http://www.gromacs.org/mailing_lists/users.php
