[vtk-developers] vtkChemistry update

[Marcus D. Hanwell]

Hi David,

On Fri, Jul 22, 2011 at 8:11 PM, David Lonie <loniedavid at gmail.com> wrote:
> Hi all,
>
> It's been a couple weeks since my last update, and I'd like to fill
> everyone in one the new developments. I've made two blog posts
> describing the Chemistry kit (with some screenshots) here:
>
> http://davidlonie.blogspot.com/2011/06/overdue-update-gsocvtkchemistry.html
> http://davidlonie.blogspot.com/2011/07/vtkchemistry-now-with-electrons.html
>
> The most recent additions have been targeting electronic data
> visualization. As with the vtkMoleculeMapper class, the
> vtkElectronMapper/Actor classes aim to be simple to use and intuitive
> to chemists. The entire pipeline to render a molecule (read from an
> OpenQube-supported QM output file) with an arbitrary molecular orbital
> (the LUMO in this case) is simply
>
This looks great David - thanks for sending an update to the list. I
would like to start working on getting some of these earlier patches
in, after perhaps a short API review. I will reply to your other post
separately.

Marcus