Anna Bui (annatbui)

annatbui

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Location:Cambridge, UK

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Anna Bui's starred repositories

openbabel

Open Babel is a chemical toolbox designed to speak the many languages of chemical data.

Language:C++License:GPL-2.0Stargazers:1014Issues:0Issues:0

rdkit

The official sources for the RDKit library

Language:HTMLLicense:BSD-3-ClauseStargazers:2511Issues:0Issues:0

DL4MolecularGraph

Literature of deep learning for graphs in Chemistry and Biology

Stargazers:195Issues:0Issues:0

pysmiles

A lightweight python-only library for reading and writing SMILES strings

Language:PythonLicense:Apache-2.0Stargazers:140Issues:0Issues:0

deepchem

Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

Language:PythonLicense:MITStargazers:5257Issues:0Issues:0