Hi, What makes you think the PME algorithm, rather than your choices of settings for it (and twenty other things), is the problem?
Mark On Wed, Jun 4, 2014 at 7:57 AM, Ali Alizadeh <ali.alizadehmoja...@gmail.com> wrote: > Dear All users, > > I have encounter this error: > > ------------- > Fatal error: > No parallel Ewald. Use PME instead. > -------------- > > I used 8 cores and gromacs 4.5.5, for doing my calculations. I should use > ewald method because > > my system can not converge using PME it heats up my system. Are there any > suggestions? > > > > -- > Sincerely > > Ali Alizadeh > -- > Gromacs Users mailing list > > * Please search the archive at > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before > posting! > > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > > * For (un)subscribe requests visit > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or > send a mail to gmx-users-requ...@gromacs.org. > -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.
