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David Buterez

4PUBLICATIONS

2CO-AUTHORS

Deep learningModelling and simulationCheminformatics and quantitative structure-activity relationshipsNeural networks

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Publications (4)

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|Feb 26, 2024

Transfer learning with graph neural networks for improved molecular property prediction in the multi-fidelity setting.

David Buterez, Jon Paul Janet, Steven J Kiddle

|Nov 29, 2023

Modelling local and general quantum mechanical properties with attention-based pooling.

David Buterez, Jon Paul Janet, Steven J Kiddle

|Apr 14, 2023

MF-PCBA: Multifidelity High-Throughput Screening Benchmarks for Drug Discovery and Machine Learning.

David Buterez, Jon Paul Janet, Steven J Kiddle

|Dec 05, 2021

CellVGAE: an unsupervised scRNA-seq analysis workflow with graph attention networks.

David Buterez, Ioana Bica, Ifrah Tariq

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Frequent Collaborators

3 joint publications

Jon Paul Janet

1 joint publications

Pietro Lió

Frequent Collaborators

3 joint publications

Jon Paul Janet

1 joint publications

Pietro Lió

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