Thank you Justin, I will add some lamda points between 0.1 to 0.5 and 0.5 to 0.9. I have a quick question related to recalculation. If I add, for example, a new lamda value of 0.3, I will set the following setting in the mdp file:
init_lambda = 0.3 delta_lambda = 0 foreign_lambda = 0.1 0.5 Does it mean that I have to repeat my simulations for 0.1 and 0.5 so that they can have foreign lambda 0.3? Thank you, Sonia Aguilera -- View this message in context: http://gromacs.5086.n6.nabble.com/BAR-histogram-results-tp5005095p5006125.html Sent from the GROMACS Users Forum mailing list archive at Nabble.com. -- gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! * Please don't post (un)subscribe requests to the list. Use the www interface or send it to gmx-users-requ...@gromacs.org. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
