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20112026
most citedAutomatic chemical design using a data-driven continuous representation of molecules

3.2k citations · 8.8k across the 71 of their papers we have counts for

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Showing 2020Show all

9 papers · 1 filter

cs.LG2020★ 1 cited

Self-Tuning Stochastic Optimization with Curvature-Aware Gradient Filtering

Ricky T. Q. Chen, Dami Choi, Lukas Balles +2

Standard first-order stochastic optimization algorithms base their updates solely on the average mini-batch gradient, and it has been shown that tracking additional quantities such…

cs.LG2020★ 4 cited

Teaching with Commentaries

Aniruddh Raghu, Maithra Raghu, Simon Kornblith +2

Effective training of deep neural networks can be challenging, and there remain many open questions on how to best learn these models. Recently developed methods to improve neural…

cs.LG2020★ 7 cited

No MCMC for me: Amortized sampling for fast and stable training of energy-based models

Will Grathwohl, Jacob Kelly, Milad Hashemi +3

Energy-Based Models (EBMs) present a flexible and appealing way to represent uncertainty. Despite recent advances, training EBMs on high-dimensional data remains a challenging prob…

cs.LG2020★ 13 cited

A Study of Gradient Variance in Deep Learning

Fartash Faghri, David Duvenaud, David J. Fleet +1

The impact of gradient noise on training deep models is widely acknowledged but not well understood. In this context, we study the distribution of gradients during training. We int…

cs.LG2020★ 55 cited

Learning Differential Equations that are Easy to Solve

Jacob Kelly, Jesse Bettencourt, Matthew James Johnson +1

Differential equations parameterized by neural networks become expensive to solve numerically as training progresses. We propose a remedy that encourages learned dynamics to be eas…

cs.LG2020★ 9 cited

SUMO: Unbiased Estimation of Log Marginal Probability for Latent Variable Models

Yucen Luo, Alex Beatson, Mohammad Norouzi +4

Standard variational lower bounds used to train latent variable models produce biased estimates of most quantities of interest. We introduce an unbiased estimator of the log margin…