[Avogadro-devel] cannot load PDB into avogadro

[Chitrak Gupta]

Dear avogadro users,

I am relatively new to Avogadro. I am facing problem loading PDB file into
avogadro.

I created a PDB file using the build feature of Avogadro, but when I try to
load the same file, I am getting the following error:

No matching basis set file found: "....filename.pdb"
HOMO at: -1


I have tried loading it from the GUI as well as drag-and-drop, both gives
the same error. Any clue how to fix this?


Best regards,
Chitrak.

[Marcus D. Hanwell]

Post by Chitrak Gupta
Dear avogadro users,
I am relatively new to Avogadro. I am facing problem loading PDB file into
avogadro.
I created a PDB file using the build feature of Avogadro, but when I try
No matching basis set file found: "....filename.pdb"
HOMO at: -1
I have tried loading it from the GUI as well as drag-and-drop, both gives
the same error. Any clue how to fix this?
Which version of Avogadro are you using? If you can send the file to me

offlist I can take a look at it, and try it locally. I don't recognize the
error.

Thanks,

Marcus