ADL: DLG Results
jackygrahamez at gmail.com
Mon Nov 19 11:22:37 PST 2007
My AD4 integration onto BOINC's distributed platform has a slight caveat.
For some reason on upload to the server, my DLG gets truncated at the lines
where it beggins reading the maps.fld. I am really having trouble figuring
out a work around. For instance here is the tail of one result:
Calculating OA-OA interaction energy versus atomic separation (2048 data
Time taken: Real= 0.00, CPU= 0.00, System= 0.00
DPF> fld pdb1mwv.maps.fld # grid_data_file
In order to get the protein ligand complex, I need the rest of the file
Any way I can run a python or even a perl script to perform the same shell
commands? I seek to port such scripts across platforms so I can distribute
the work over the internet.
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