Dear all, I have been reading the literature, mailing list and the manual.
There is some questions that I cant understand: 1) there is three methods for the pull code: constraint force, AFM and umberalla. in both AFM and Constraint force, there is an option of the rate of pulling (contraint_rate, AFM_rate), however, for umberalla, there is only two options, a foce constant and position to be specified! my question is: how is the pulling controlled in umberalla sampling option? 2) if I want to do an AFM pulling...what is a reasonalble force constant to use? it seems people are using different K ranging from 10 to 1000's? thank u Belquis _______________________________________________ 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
