Skip to content

Commit

Permalink
Update patch_mmcif README
Browse files Browse the repository at this point in the history
  • Loading branch information
neoformit committed Oct 29, 2024
1 parent ed43c79 commit 63f21fd
Showing 1 changed file with 5 additions and 3 deletions.
8 changes: 5 additions & 3 deletions tools/alphafold/scripts/db/patch_mmcif/README.md
Original file line number Diff line number Diff line change
Expand Up @@ -11,18 +11,20 @@ FileNotFoundError: [Errno 2] No such file or directory: '/alphafold_dbs/pdb_mmci

## Usage

- Copy this script to your server
- Copy the script to your server
- Ensure that `python >= 3.8` is available
- `pip install requests`
- Run patch_mmcif.py from any directory
- Run `patch_mmcif.py` from any directory

You must specify the path to your databases when you run the script.

```
$ python patch_mmcif.py --help
usage: patch_mmcif.py [-h] [-i ID] [--write-db] [--log] db_path
Patch missing MMCIF files in your AlphaFold DB. This script will sniff your databases for missing .cif files and download them from the RCSB PDB. If the --write-db flag is set, the files will be copied directly to the AlphaFold database mmcif_files directory.
Patch missing MMCIF files in your AlphaFold DB. This script will sniff your databases for
missing .cif files and download them from the RCSB PDB. If the --write-db flag is set,
the files will be copied directly to the AlphaFold database mmcif_files directory.
Example usage:
Expand Down

0 comments on commit 63f21fd

Please sign in to comment.