Data Scientist, Cheminformatician, Python programmer, Lead @oddt developer,
Cheminformatics Lead, DiCE, @merckgroup
- Warsaw
- @wojcikowskim
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openbabel/openbabel
openbabel/openbabel PublicOpen Babel is a chemical toolbox designed to speak the many languages of chemical data.
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ajtulloch/sklearn-compiledtrees
ajtulloch/sklearn-compiledtrees PublicCompiled Decision Trees for scikit-learn
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oddt/rfscorevs
oddt/rfscorevs PublicRF-Score-VS - Random forest based protein-ligand scoring function for Virtual Screening
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