Skip to content

Commit

Permalink
add notes
Browse files Browse the repository at this point in the history
  • Loading branch information
ntxxt authored Mar 19, 2024
1 parent 04b5764 commit 9a20f91
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion README.md
Original file line number Diff line number Diff line change
Expand Up @@ -186,4 +186,4 @@ The command above will generate a folder in the current working directory, conta
model.test(hdf5 = "tmpdir/GNN_esm_prediction.hdf5")
```
### Note about input pdb files
To make sure the mapping between interface residue and ems-2 embeddings are correct, make sure that for all the chains, residue numbering in the PDB file is continuous and start with residue '1'.
To make sure the mapping between interface residue and ems-2 embeddings are correct, make sure that for all the chains, residue numbering in the PDB file is continuous and starts with residue '1'. We provide a script (scripts/pdb_renumber.py) to do the numbering.

0 comments on commit 9a20f91

Please sign in to comment.