Dear gmx users, I was trying to use the Force-Switch as the vdv-modifier with Verlet cutoff scheme. The use of Force-Switch produces the following error:
*ERROR 1 [file grompp.mdp, line 63]: Invalid enum 'force-switch' for variable vdw-modifier, using 'Potential-shift-Verlet' Next time use one of: 'Potential-shift-Verlet' 'Potential-shift' 'None' 'Potential-switch' 'Exact-cutoff'* I am using the 4.6.6 version of GPU enabled gromacs. Please let me know how do I circumvent the error. The snippet of the mdp file is here: ; NEIGHBOR SEARCHING cutoff-scheme = Verlet nstlist = 10 ns_type = grid pbc = xyz ; Method for doing Van der Waals vdw-modifier = force-switch ; cut-off lengths rvdw_switch = 1.1 rvdw = 1.3 Thanks Chandan -- Chandan Kumar Choudhury National Chemical Laboratory, Pune India *"All work and no play makes Jack a dull boy...”* -- 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.
