[gmx-developers] table exclusion in electrostatics

[David]

On Wed, 2003-07-02 at 22:24, Anjan Raghunathan wrote:
> Hi,
> 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?
> 
you need to check everywhere that the variable forecrec->eel_type is
used (not just in force.c).

Are you sure that you cannot use the normal table functionality?

> Anjan
> 
> _______________________________________
> 
> Anjan V. Raghunathan
> Graduate Research Assistant
> Computational Electronics Group
> 3213 Beckman Institute,
> Univ. of Illinois at Urbana-Champaign.
> 
> E-mail:araghuna at uiuc.edu 
> Off: 217-244-1964
> Res: 217-355-5418
> _______________________________________________
> gmx-developers mailing list
> gmx-developers at gromacs.org
> http://www.gromacs.org/mailman/listinfo/gmx-developers
> Please don't post (un)subscribe requests to the list. Use the 
> www interface or send it to gmx-developers-request at gromacs.org.
-- 
Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, 	Dept. of Cell and Molecular Biology
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++