Dear all:
I am dealing with a SHELXL/ BAVERAGE issue.
I have refined a few structures in SHELXL but I think I am not converting properly the coordinates into the .pdb format. I am trying to use Baverage but I get an error
The program run with command: baverage XYZIN "C:/datasets/34_MolP.pdb" XYZOUT "C:/datasets/34_MolP_baverage1.pdb" RMSTAB "C:/datasets/34_MolP_bavrmstab1.txt"
has failed with error message
BAVERAGE: XYZOPEN: Error opening logical name XYZIN
Thank you very much. Any comments will be appreciated.
Fátima
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