/tools/2040FBDBIC
2040FBDBIC
UAMCAntwerpen/2040FBDBIC
9 stars3 forksJupyter NotebookAdded February 4, 2026
summary
This repository provides course materials for a class on chemo-informatics and computational drug design at the University of Antwerp. It covers various topics related to drug discovery, molecular dynamics, and cheminformatics, making it a valuable resource for learning about molecular tools.
description
This repository contains all the course materials that are used in the "Chemo-informatics and computational drug design" course teaches at the University of Antwerp (Belgium)
topics
cheminformaticscomputational-chemistrycoursedrug-designdrug-discoveryglidemachine-learningmaestromolecular-dynamicsmolecular-dynamics-simulationmolecular-mechanicspharmacophore-modellingpythonrdkitschrodingervirtual-machinevirtual-screeningdrug-receptor-interactionuniversiteit-antwerpen
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