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tessl/pypi-padelpy

A Python wrapper for PaDEL-Descriptor software that enables molecular descriptor and fingerprint calculation from SMILES, MDL, and SDF inputs

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tile.json

{
  "name": "tessl/pypi-padelpy",
  "version": "0.1.0",
  "docs": "docs/index.md",
  "describes": "pkg:pypi/padelpy@0.1.16",
  "summary": "A Python wrapper for PaDEL-Descriptor software that enables molecular descriptor and fingerprint calculation from SMILES, MDL, and SDF inputs"
}

Install with Tessl CLI

npx tessl i tessl/pypi-padelpy

tile.json