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Drug Combination Prediction using Graph Neural Networks

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DCGG

The source code for paper published in "Progress in Artificial Intelligence" journal. DOI: 10.1007/s13748-024-00314-3.

DCGG is a novel approach towards drug combination prediction utilizing graph neural networks and graph auto encoders. The approach comprises of 6 different models and 7 different graphs. The graphs are augmented with differenet node features including drug indicatinos, drug side-effects, and node2vec drug features extracted from drug-drug-interaction network.

Submitted to Briefings in Bioinformatics

DCGG: Drug Combination prediction using GNN and GAE

Authors: S.S. Ziaee, H. Rahmani, M. Tabatabaei, Anna H.C. Vlot, Andreas Bender

DCGG main steps:

DCGG main Steps

Notes:

To run the codes please use these versions of softwares and libraries:

Python 3.9, Pytorch 1.11, torch geometric 2.0.4, Numpy 1.18.1, and Pandas 1.0.1.

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