Re: [Apbs-users] Obtaining the electric field at a certain distance from the protein

[Baker, N. <Nat...@pn...>]

Hello --

We don't currently have a program that does this; however, it could be easily implemented by modifying the tool multivalue.c to replace the call to Vgrid_value with a call to Vgrid_gradient.

I hope this helps.

Thanks,

__________________________________________________ 
Nathan Baker 
Pacific Northwest National Laboratory
Tel:  509-375-3997
http://kdi.pnnl.gov/bios/baker.stm


> -----Original Message-----
> From: Cuauhtemoc Moctezuma [mailto:nez...@gm...]
> Sent: Wednesday, June 15, 2011 4:49 PM
> To: apb...@li...
> Subject: [Apbs-users] Obtaining the electric field at a certain distance
> from the protein
> 
> Hi
> 
> I am interested in obtaining the value of the electric field at a
> specific point around a protein. I am not interested in visualizing
> the field lines, but rather to get an actual numerical value. Is there
> a way to do this?
> 
> Thanks!
> Miguel
> 
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