[gmx-developers] table exclusion in electrostatics
araghuna at uiuc.edu
Wed Jul 2 22:24:50 CEST 2003
If I need to exclude the use of tables for calculating electrostatics and include my own function for that, which function call(s) do I need to disable?
I am planning to use a separate switch for this electrostatic calculating function(by adding an enumerator to the already existing PPPM,PME...etc). Any suggestions on how I would go about this?
Anjan V. Raghunathan
Graduate Research Assistant
Computational Electronics Group
3213 Beckman Institute,
Univ. of Illinois at Urbana-Champaign.
E-mail:araghuna at uiuc.edu
More information about the gromacs.org_gmx-developers