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command-line-wrapper

Here are 2 public repositories matching this topic...

ecrl / padelpy

A Python wrapper for PaDEL-Descriptor software

python computational-chemistry padel molecular-fingerprints command-line-wrapper molecular-descriptors

Updated Nov 10, 2023
Python

ecrl / alvadescpy

A Python wrapper for alvaDesc software

computational-chemistry molecular-fingerprints command-line-wrapper molecular-descriptors

Updated Oct 15, 2024
Python

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