Is there some sort of guide about this part of the VTK code? I mean, I am working with an electronic structure package and it would be great if there was a way to "interface" it with ParaView.<div><br><div class="gmail_quote">
Il giorno 15 marzo 2012 16:48, Marcus D. Hanwell <span dir="ltr"><<a href="mailto:marcus.hanwell@kitware.com">marcus.hanwell@kitware.com</a>></span> ha scritto:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
<div class="im">On Thu, Mar 15, 2012 at 11:29 AM, Roberto Di Remigio<br>
<<a href="mailto:roberto.diremigio@gmail.com">roberto.diremigio@gmail.com</a>> wrote:<br>
> Sorry for taking the discussion out of the mailing list! I hadn't noticed.<br>
> I tried with the Resample filter and it worked.<br>
> For future use, I summarize what I did:<br>
> 1. open first cube file (containing the density);<br>
> 2. plot the isodensity surface;<br>
> 3. open second cube file (containing the electrostatic potential);<br>
> 4. use Resample With Dataset filter. Select Gridded Data of the second cube<br>
> file as Input and Contour of the first cube file as Source.<br>
> This should do it.<br>
> Thank you again for your answers<br>
><br>
</div>Just to add that we have added more chemistry to VTK, in the form of<br>
Blue Obelisk Data Repository for atom colors, radii, symbols, names,<br>
etc along with things like a vtkMolecule data structure and a simple<br>
bond perceiver. This should hopefully gain some exposure in future<br>
ParaView releases so that it is easier to view molecular structure and<br>
related data.<br>
<span class="HOEnZb"><font color="#888888"><br>
Marcus<br>
</font></span></blockquote></div><br><br clear="all"><div><br></div>-- <br>Roberto Di Remigio<br><br>
</div>