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UCT Prague; Department of Informatics and Chemistry
- Prague, Czech Republic
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QSPRpred
QSPRpred PublicForked from CDDLeiden/QSPRpred
A tool for creating Quantitative Structure Property Relationship (QSPR) models.
Jupyter Notebook
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ECFPinvert
ECFPinvert PublicForked from dehaenw/ECFPinvert
Algorithmic inversion of extended connectivity fingerprints (ECFP)
Python
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