[Chimera-users] How to display automatically the atoms in Gaussian cube file format

Thomas Goddard goddard at cgl.ucsf.edu
Mon Jan 26 14:30:05 PST 2009


Hi Hyung,

   The Chimera Gaussian cube file reader ignores the atoms specified in 
the file and just displays the volume data.  I'll add to our requested 
features list an entry to also display the atoms.  There are hundreds of 
new features requested and I do not know when this one might get done. 
Eric Pettersen says that if you have a Gaussian checkpoint file with the 
same atoms you can open that and it will display the atoms.

	Tom


Hyung Jun Lee wrote:
> Gaussian cube file formats include the information about each atom's 
> positions as well as the volumetric data. But, Chimera only displays the 
> volumetric data when importing the cube file format.
>  
> I want to know how to display automatically the atoms whose positions is 
> included in the cube file, together with the volumetric data.
> 
> 
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