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actual_mabel's Projects

cv icon cv

this repository is about some pdf or word documents

gnnpapers icon gnnpapers

Must-read papers on graph neural networks (GNN)

intro-to-qml icon intro-to-qml

Introduction to QML representations, both how they are constructed and how to generate them using the qmlcode.

keggdrugvirtualscreening icon keggdrugvirtualscreening

A software for analysis and fast virtual screen of KEGG_DRUG molecular database of accepted drugs classificated by ATC codes

kgem-in-drug-discovery icon kgem-in-drug-discovery

Code to accompany the "Understanding the Performance of Knowledge Graph Embeddings in Drug Discovery" manuscript (Artificial Intelligence in the Life Sciences, 2022)

kgnn icon kgnn

Source Code for IJCAI'20 "KGNN: Knowledge Graph Neural Network for Drug-Drug Interaction Prediction"

r4ds icon r4ds

R for data science: a book

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