Re: [gmx-users] System has non-zero total charge: -8.000001e+00

Maurício Menegatti Rigo wrote: IS this a problem? /System has non-zero total charge: -8.01e+00/ If yes, can I fix that changing COulomb cutt-off to PME electrostatics? You need to add counterions to your system. Consult some basic tutorial material, as well as the manual entry for

Re: [gmx-users] System has non-zero total charge: -8.000001e+00

You should always neutralise your sysem. On Thu, Feb 25, 2010 at 1:42 PM, Maurício Menegatti Rigo mauriciomr1...@gmail.com wrote: IS this a problem? *System has non-zero total charge: -8.01e+00* If yes, can I fix that changing COulomb cutt-off to PME electrostatics? THanks!! --