Multithreaded Tanimoto Similarity for RDKit Fingerprints.
Project description
smiles-fp
Installation
# on Linux only
sudo apt install libfreetype-dev
git clone https://github.com/audivir/smiles-fp
cd smiles-fp
# set the correct RDKit version
python build_smiles_fp.py <smiles_fp_version> <rdkit_version>
pip install ".[dev]" # uv pip install ".[dev]"
pytest tests
Release history Release notifications | RSS feed
Download files
Download the file for your platform. If you're not sure which to choose, learn more about installing packages.
Source Distribution
smiles_fp-0.1.2025.3.5.tar.gz
(13.4 kB
view details)
File details
Details for the file smiles_fp-0.1.2025.3.5.tar.gz.
File metadata
- Download URL: smiles_fp-0.1.2025.3.5.tar.gz
- Upload date:
- Size: 13.4 kB
- Tags: Source
- Uploaded using Trusted Publishing? No
- Uploaded via: twine/6.2.0 CPython/3.10.18
File hashes
| Algorithm | Hash digest | |
|---|---|---|
| SHA256 |
bb85813e91c7147712cfbc38dbabd31b08a8580aac1696b5c9fc62a004d7b280
|
|
| MD5 |
b55b6798e0a9566fd7d6a722d4acb253
|
|
| BLAKE2b-256 |
1e5f9904b222f4128a66541a88c3ac132e8c4f4de73c09664d2d80420bb61ca6
|
