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ICML 2022 Workshop on Computational Biology and 12th EETN Conference on Artificial Intelligence (SETN 2022)

Mass Enhanced Node Embeddings for Drug Repurposing

Michail Chatzianastasis, Giannis Nikolentzos, Michalis Vazirgiannis

We propose a node embedding algorithm for the problem of drug repurposing. The proposed algorithm learns node representations that capture the influence of nodes in the biological network by learning a mass term for each node along with ...

AAAI 2023

Graph Ordering Attention Networks

Michail Chatzianastasis, Johannes Lutzeyer, George Dasoulas, Michalis Vazirgiannis

We introduce the Graph Ordering Attention (GOAT) layer, a novel GNN component that learns local node orderings via an attention mechanism and processes the ordered representations using a recurrent neural network aggregator.

AAAI 2024, Spotlight at DGM4H Neurips 2023 and AI4Science Neurips 2023

Prot2Text: Multimodal Protein’s Function Generation with GNNs and Transformers

Hadi Abdine, Michail Chatzianastasis, Costas Bouyioukos, Michalis Vazirgiannis

We propose Prot2Text, which predicts a protein function’s in a free text style, moving beyond the conventional binary or categorical classifications. By combining Graph Neural Networks(GNNs) and Large Language Models(LLMs), in an encoder...

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