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.
Il giorno 15 marzo 2012 16:48, Marcus D. Hanwell <[email protected] > ha scritto: > On Thu, Mar 15, 2012 at 11:29 AM, Roberto Di Remigio > <[email protected]> wrote: > > Sorry for taking the discussion out of the mailing list! I hadn't > noticed. > > I tried with the Resample filter and it worked. > > For future use, I summarize what I did: > > 1. open first cube file (containing the density); > > 2. plot the isodensity surface; > > 3. open second cube file (containing the electrostatic potential); > > 4. use Resample With Dataset filter. Select Gridded Data of the second > cube > > file as Input and Contour of the first cube file as Source. > > This should do it. > > Thank you again for your answers > > > Just to add that we have added more chemistry to VTK, in the form of > Blue Obelisk Data Repository for atom colors, radii, symbols, names, > etc along with things like a vtkMolecule data structure and a simple > bond perceiver. This should hopefully gain some exposure in future > ParaView releases so that it is easier to view molecular structure and > related data. > > Marcus > -- Roberto Di Remigio
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