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A chemically complete tokenizer for OpenSMILES

Project description

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.

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pip install smirk

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  • Uploaded via: uv/0.9.26 {"installer":{"name":"uv","version":"0.9.26","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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