Many thanks, can you tell me the reason? becuase I see in the old manual, there said "if there is fixed part in the system, then you can not use the removal of the center of the mass." XJ
2012/2/21, Yang Ye <[email protected]>: > yes. you need to and can still put System for the removal group. > >> >> On Feb 21, 2012 5:51 PM, "xiaojing gong" <[email protected]> wrote: >>> >>> Dear all, >>> I used the GMX 4.5.5 to run a simulation with a fixed plane and > water. >>> I wonder to know if I fix the plane, shall I use the command of >>> the removal of the center of mass for water? I will appreciate it if >>> you will share your opion. >>> >>> Many thanks >>> XJ >>> -- >>> gmx-users mailing list [email protected] >>> 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 [email protected]. >>> Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > -- gmx-users mailing list [email protected] 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 [email protected]. Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
