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20172025
most citedPre-training via Denoising for Molecular Property Prediction

30 citations · 119 across the 12 of their papers we have counts for

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10 papers · 1 filter

cs.LG2024

Neural Compression of Atmospheric States

Piotr Mirowski, David Warde-Farley, Mihaela Rosca +7

Atmospheric states derived from reanalysis comprise a substantial portion of weather and climate simulation outputs. Many stakeholders -- such as researchers, policy makers, and in…

cs.LG2023★ 1 cited

Spatial Functa: Scaling Functa to ImageNet Classification and Generation

Matthias Bauer, Emilien Dupont, Andy Brock +3

Neural fields, also known as implicit neural representations, have emerged as a powerful means to represent complex signals of various modalities. Based on this Dupont et al. (2022…

cs.LG2022★ 2 cited

When Does Re-initialization Work?

Sheheryar Zaidi, Tudor Berariu, Hyunjik Kim +4

Re-initializing a neural network during training has been observed to improve generalization in recent works. Yet it is neither widely adopted in deep learning practice nor is it o…

cs.LG2022★ 30 cited

Pre-training via Denoising for Molecular Property Prediction

Sheheryar Zaidi, Michael Schaarschmidt, James Martens +6

Many important problems involving molecular property prediction from 3D structures have limited data, posing a generalization challenge for neural networks. In this paper, we descr…

cs.LG2022★ 3 cited

Learning Instance-Specific Augmentations by Capturing Local Invariances

Ning Miao, Tom Rainforth, Emile Mathieu +4

We introduce InstaAug, a method for automatically learning input-specific augmentations from data. Previous methods for learning augmentations have typically assumed independence b…

cs.LG2022★ 23 cited

From data to functa: Your data point is a function and you can treat it like one

Emilien Dupont, Hyunjik Kim, S. M. Ali Eslami +2

It is common practice in deep learning to represent a measurement of the world on a discrete grid, e.g. a 2D grid of pixels. However, the underlying signal represented by these mea…