[vtkusers] PDB and GaussianCube reader for molecular graphics

[Jean M. Favre]

For anyone interested, I have 2 classes to read data from 2 well known
Molecular Data formats (PDB ATOM records and Gaussian Cube).

vtkMoleculeReader accepts both types (PDB and GaussianCube) and creates
a vtkPolyData (display of atoms and bonds is via glyphs and tubes)

vtkGaussianCubeReader creates a vtkStructuredPoints and display is done
via isosurface, cutting planes, volume rendering, etc...

I also have the XML description to add the readers to ParaView.

Send me mail if you'd like a copy of my source code. 

PDB link:
http://www.rcsb.org/pdb/docs/format/pdbguide2.2/guide2.2_frame.html
Gaussian Cube link: http://www.gaussian.com/00000430.htm

-- 
Dr. Jean M. Favre,                            email:favre at cscs.ch
http://www.cscs.ch/people/Favre.html
CSCS, Swiss Center for Scientific Computing | Tel:  +41 (91) 610.82.40
Via Cantonale, 6928 Manno, Switzerland      | Fax:  +41 (91) 610.82.82