Bob,
If it helps, this is my message call back on MEP and VDW from the Jmol
menu:
isosurface1 created with cutoff=NaN min=0.0 max=0.0; number of isosurfaces
= 0
The following point is not a problem, but I'll mention it because it might
be related:
isosurfaceArea
The used to back as a decima
Bob,
Molecular Electrostatic Potential appears to be broken on 12.1.30_dev. I
can't map the surface via the Jmol menu or Jmol script on my page. The Jmol
menu sees that partial charges are there, but no mapping occurs.
Otis
--
Otis Rothenberger
Department of Chemistry
Illinois State Univer
OK, thanks, Alexander. I see. Dots are not properly being filtered with
isosurface SET or isosurface POCKET, and isosurface POCKET and SASURFACE got
broken in this last installment of Jmol 12.1.
Fixed for Jmol 12.1.30 and 12.0.27. Corrected 12.1.30 is at
http://chemapps.stolaf.edu/jmol/docs/exampl
Oh, I see them now. Hmm...
On Sun, Jan 9, 2011 at 7:04 PM, Robert Hanson wrote:
>
>
> On Sun, Jan 9, 2011 at 5:49 PM, Alexander Rose <
> alexander.r...@weirdbyte.de> wrote:
>
>>
>> I drew them (http://dl.dropbox.com/u/3778149/1crn_surface-points.jmol)
>> and notices that there are a lot of point
On Sun, Jan 9, 2011 at 5:49 PM, Alexander Rose
wrote:
>
> I drew them (http://dl.dropbox.com/u/3778149/1crn_surface-points.jmol) and
> notices that there are a lot of points in addition to the vertices of the
> triangles that make up the surface. What are they? Can I get rid of them?
>
>
They are
Hi,
Am 21.12.2010 um 16:46 schrieb Robert Hanson:
> The gridpoints are cleared from memory after use, and in many cases they are
> "streamed" so as never to accumulate. But do you perhaps mean the vertices of
> the triangles that make up the surface? You do have access to those points:
>
> pri
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