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Smirk: A Tokenizer for OpenSMILES

GitHub License paper data arXiv:2409.15370

Smirk is a chemistry-specific tokenizer that provides complete coverage of the OpenSMILES specification, that is built using Rust 🦀 and HuggingFace's tokenizers 🤗. Installation is easy, and Smirk works out-of-the-box with the HuggingFace ecosystem.

Check our documentation to see smirk in action, or read the paper to learn about tokenization for molecular foundation models.

Installation

pip install smirk

Project links

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Newer release available (0.3.0)

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Avatar for awadell from gravatar.com awadell

Credits

Author: Anoushka Bhutani

GitHub Statistics

Data verified by PyPI on Jul 30, 2026
The GitHub source repository was provided by the project maintainers and verified by PyPI at the time of upload. Stars, forks, and open issues/PRs are derived from that repository and have not been independently verified.

License

Apache-2.0

Requires

Python >=3.9

Classifiers

Report project as malware

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Details for the file smirk-0.2.1-cp310-cp310-manylinux_2_17_aarch64.manylinux2014_aarch64.whl.

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  • Download URL: smirk-0.2.1-cp310-cp310-manylinux_2_17_aarch64.manylinux2014_aarch64.whl
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  • Size: 2.4 MB
  • Tags: CPython 3.10, manylinux: glibc 2.17+ ARM64
  • Uploaded using Trusted Publishing? Yes
  • Uploaded via: uv/0.12.0 {"installer":{"name":"uv","version":"0.12.0","subcommand":["publish"]},"python":null,"implementation":{"name":null,"version":null},"distro":{"name":"Ubuntu","version":"24.04","id":"noble","libc":null},"system":{"name":null,"release":null},"cpu":null,"openssl_version":null,"setuptools_version":null,"rustc_version":null,"ci":true}

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