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COSMolKit — Rust-native cheminformatics toolkit
COSMolKit — Rust-native cheminformatics toolkit

User Guide

  • Installation
  • Quick Start
  • ConfSeq
  • Molecule Values
  • Batch Workflows
  • Fingerprints
  • Molecular Descriptors
  • Protein Structures
  • File IO and Arrays
  • API Reference
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Python Module Index

c
 
c
cosmolkit
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Project and Rust crates

Source repository cosmolkit Rust facade crate cosmolkit-core chemistry crate cosmolkit-inchi crate cosmolkit-ringdecomposer crate Rust API documentation COSMolKit Python package Documentation Web tools