pyscreener: A Python Wrapper for Computational Docking Software

pyscreener: A Python Wrapper for Computational Docking Software - Published in JOSS (2022)

https://github.com/coleygroup/pyscreener.git

Science Score: 87.0%

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    Found 1 DOI reference(s) in JOSS metadata
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    Published in Journal of Open Source Software
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JOSS Publication

pyscreener: A Python Wrapper for Computational Docking Software
Published
March 16, 2022
Volume 7, Issue 71, Page 3950
Authors
David E. Graff ORCID
Department of Chemistry and Chemical Biology, Harvard University, Department of Chemical Engineering, Massachusetts Institute of Technology
Connor W. Coley ORCID
Department of Chemical Engineering, Massachusetts Institute of Technology, Department of Electrical Engineering and Computer Science, Massachusetts Institute of Technology
Editor
Richard Gowers ORCID
Tags
drug discovery distributed computing molecular docking