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Moad dataset broken archive

Open rpowalski opened this issue 11 months ago • 5 comments

Hello Team, I have some trouble with following the dataset loader for the Moad dataset. This line suggests that there should be a directory pdb_ligand in the moad archive.

I downloaded and extracted the archive shared in here, but this directory is missing. To be sure I did it twice on different machines.

Here is what I see when I extracted the archive. Can you please share some advice on this?

obraz

rpowalski avatar Mar 12 '24 22:03 rpowalski

I had the same as the download failed twice. Then it was ok . the un tar take time. Howevar, I had another problem when I tried to use NotADirectoryError: [Errno 20] Not a directory: '.....DiffDock/data/BindingMOAD_2020_processed/pdb_protein/._6hd6_1_protein.pdb/._6hd6_1_protein.pdb_protein.pdb'

Alain-chavanieu avatar Mar 21 '24 17:03 Alain-chavanieu

@rpowalski, I also am not seeing the pdb_ligand directory in the downloaded MOAD archive. This is after trying to download it using wget three separate times.

amorehead avatar Mar 27 '24 14:03 amorehead

Same here. Couldn't find pdb_ligand.

Harper-Hua avatar Apr 16 '24 21:04 Harper-Hua

@jsilter, any chance you might be able to confirm the issue we are encountering here?

amorehead avatar May 06 '24 16:05 amorehead

I also found that pdb_ligand is missing from the BindingMOAD.tar archive. In my experience with the MOAD.py file, the DockGen/processed_files directory contains all of the files needed with a similar naming convention (just add "_ligand.pdb")

echen1214 avatar Sep 11 '24 21:09 echen1214