이진희 wrote: > > > Dear all > > > > When I run produnction run using freeze backbone in GROMACS 4.0.5, the > error was shown. > > But I didn't use freeze backboone, the error wasn't shown. > > ------------------------------------------------ > > Step 1 Warning: Pressure scaling more than 1%. > > ------------------------------------------------ > > I changed "tau_p" value from 0.5 to 5 in md.mdp file, but the above > error was shown. > > I don't know how to solve it. Any one give some advice.
Provide a full description. What's the system, how big is it, how did you equilibrate it, why/how are you freezing the backbone, does the run finish, does the trajectory look ok? Mark -- 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/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/mailing_lists/users.php
