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Author:
None
Summary:
Modular pipeline for fetching, curating, and encoding molecular datasets using PubChem data and RDKit's Morgan fingerprinting algorithm.
Latest version:
0.1.1
Required dependencies:
numpy
|
pandas
|
pydantic
|
pyyaml
|
rdkit
|
requests
Optional dependencies:
build
|
hatchling
|
mkdocs
|
mkdocs-material
|
mkdocstrings
|
pytest
|
twine
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