Dear gmx-users, It is known that if system have an absolute reference, the removal of COM could lead to artifacts. However, for instance, when one water slab adsorbs on a freezed, infinite graphite surface, the COM motion is still free in x or y direction, and subsequently leads to net flows during long time simulations. I wanna know if there is a solution for this case. Any suggestions will be appreciated.
Best regards, Bert -- 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
