most citedExtreme Acceleration of Graph Neural Network-based Prediction Models for Quantum Chemistry

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cs.LG2023

PopSparse: Accelerated block sparse matrix multiplication on IPU

Zhiyi Li, Douglas Orr, Valeriu Ohan +5

Reducing the computational cost of running large scale neural networks using sparsity has attracted great attention in the deep learning community. While much success has been achi…

cs.LG2022★ 1 cited

Extreme Acceleration of Graph Neural Network-based Prediction Models for Quantum Chemistry

Hatem Helal, Jesun Firoz, Jenna Bilbrey +5

Molecular property calculations are the bedrock of chemical physics. High-fidelity \textit{ab initio} modeling techniques for computing the molecular properties can be prohibitivel…