Chaitanya K. Joshi
Chaitanya K. Joshi
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Chemistry
A Hitchhiker's Guide to Geometric GNNs for 3D Atomic Systems
A ‘Hitchhiker’s Guide’ for getting started with deep neural networks for 3D structural biology & chemistry – we wrote it without the goal of publishing at particular venues – as if we could travel back in time and learn from it if we were starting our PhDs today! 🤗
Alexandre Duval
,
Simon V. Mathis
,
Chaitanya K. Joshi
,
Victor Schmidt
,
Santiago Miret
,
Fragkiskos D. Malliaros
,
Taco Cohen
,
Pietro Liò
,
Yoshua Bengio
,
Michael Bronstein
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Benchmarking Graph Neural Networks
Open-source benchmarking framework to identify scalable and powerful GNN architectures, and track the progress of graph representation learning research.
(500+ citations, 2000+ GitHub stars)
Vijay Prakash Dwivedi
,
Chaitanya K. Joshi
,
Luu Anh Tuan
,
Thomas Laurent
,
Yoshua Bengio
,
Xavier Bresson
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