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vs-utils

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Virtual screening and cheminformatics utilities

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Name		Name	Last commit message	Last commit date
vs_utils		vs_utils
.gitignore		.gitignore
.pylintrc		.pylintrc
LICENSE		LICENSE
README.md		README.md
pre-commit		pre-commit
requirements.txt		requirements.txt
setup.py		setup.py

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vs-utils

Virtual screening and cheminformatics utilities

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rdkit
Some featurizations utilize the Antechamber and PBSA programs in AmberTools, which are licensed under the GNU GPL (version 3).

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Virtual screening and cheminformatics utilities

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14 stars

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