[gmx-users] regd neglecting short range coulomb

Anjan Raghunathan araghuna at uiuc.edu
Tue Feb 3 16:37:01 CET 2004

     I'd like to know if there is a way to neglect short range coulomb force that is getting calculated along with other non bonded interations like LJ. I just want non electrostatic non bonded interactions like LJ to be calculated and updated during neighbour search step.
     Is there a way to set rcoulomb to 0 so that this would be neglected even though there is charge in the system?

Suggestions would be appreciated..


More information about the gromacs.org_gmx-users mailing list