ICLR 2021 Papers

International Conference on Learning Representations

Decision breakdown

860papers

Counted from the official paper list; may differ slightly from the number the conference announced.

  • Oral
    536.2%
  • Spotlight
    11413.3%
  • Poster
    69380.6%

Browse all papers

Practical Massively Parallel Monte-Carlo Tree Search Applied to Molecular Design

Xiufeng Yang, Tanuj Aasawat, Kazuki Yoshizoe

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It is common practice to use large computational resources to train neural networks, known from many examples, such as reinforcement learning applications. However, while massively parallel computing is often used for training models, it is rarely used to search solutions for combinatorial optimization problems. This paper proposes a novel massively parallel Monte-Carlo Tree Search (MP-MCTS) algorithm that works efficiently for a 1,000 worker scale on a distributed memory environment using multiple compute nodes and applies it to molecular design. This paper is the first work that applies distributed MCTS to a real-world and non-game problem. Existing works on large-scale parallel MCTS show efficient scalability in terms of the number of rollouts up to 100 workers. Still, they suffer from the degradation in the quality of the solutions. MP-MCTS maintains the search quality at a larger scale. By running MP-MCTS on 256 CPU cores for only 10 minutes, we obtained candidate molecules with similar scores to non-parallel MCTS running for 42 hours. Moreover, our results based on parallel MCTS (combined with a simple RNN model) significantly outperform existing state-of-the-art work. Our method is generic and is expected to speed up other applications of MCTS.

Poster
Private Post-GAN Boosting

Marcel Neunhoeffer, Steven Wu, Cynthia Dwork

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Differentially private GANs have proven to be a promising approach for generating realistic synthetic data without compromising the privacy of individuals. Due to the privacy-protective noise introduced in the training, the convergence of GANs becomes even more elusive, which often leads to poor utility in the output generator at the end of training. We propose Private post-GAN boosting (Private PGB), a differentially private method that combines samples produced by the sequence of generators obtained during GAN training to create a high-quality synthetic dataset. To that end, our method leverages the Private Multiplicative Weights method (Hardt and Rothblum, 2010) to reweight generated samples. We evaluate Private PGB on two dimensional toy data, MNIST images, US Census data and a standard machine learning prediction task. Our experiments show that Private PGB improves upon a standard private GAN approach across a collection of quality measures. We also provide a non-private variant of PGB that improves the data quality of standard GAN training.

Poster
FedBN: Federated Learning on Non-IID Features via Local Batch Normalization

Xiaoxiao Li, Meirui JIANG, Xiaofei Zhang, Michael Kamp, Qi Dou

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The emerging paradigm of federated learning (FL) strives to enable collaborative training of deep models on the network edge without centrally aggregating raw data and hence improving data privacy. In most cases, the assumption of independent and identically distributed samples across local clients does not hold for federated learning setups. Under this setting, neural network training performance may vary significantly according to the data distribution and even hurt training convergence. Most of the previous work has focused on a difference in the distribution of labels or client shifts. Unlike those settings, we address an important problem of FL, e.g., different scanners/sensors in medical imaging, different scenery distribution in autonomous driving (highway vs. city), where local clients store examples with different distributions compared to other clients, which we denote as feature shift non-iid. In this work, we propose an effective method that uses local batch normalization to alleviate the feature shift before averaging models. The resulting scheme, called FedBN, outperforms both classical FedAvg, as well as the state-of-the-art for non-iid data (FedProx) on our extensive experiments. These empirical results are supported by a convergence analysis that shows in a simplified setting that FedBN has a faster convergence rate than FedAvg. Code is available at https://github.com/med-air/FedBN.

Poster
Parameter Efficient Multimodal Transformers for Video Representation Learning

Sangho Lee, Youngjae Yu, Gunhee Kim, Thomas Breuel, Jan Kautz, Yale Song

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The recent success of Transformers in the language domain has motivated adapting it to a multimodal setting, where a new visual model is trained in tandem with an already pretrained language model. However, due to the excessive memory requirements from Transformers, existing work typically fixes the language model and train only the vision module, which limits its ability to learn cross-modal information in an end-to-end manner. In this work, we focus on reducing the parameters of multimodal Transformers in the context of audio-visual video representation learning. We alleviate the high memory requirement by sharing the parameters of Transformers across layers and modalities; we decompose the Transformer into modality-specific and modality-shared parts so that the model learns the dynamics of each modality both individually and together, and propose a novel parameter sharing scheme based on low-rank approximation. We show that our approach reduces parameters of the Transformers up to 97%, allowing us to train our model end-to-end from scratch. We also propose a negative sampling approach based on an instance similarity measured on the CNN embedding space that our model learns together with the Transformers. To demonstrate our approach, we pretrain our model on 30-second clips (480 frames) from Kinetics-700 and transfer it to audio-visual classification tasks.

Poster
Sharpness-aware Minimization for Efficiently Improving Generalization

Pierre Foret, Ariel Kleiner, Hossein Mobahi, Behnam Neyshabur

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In today's heavily overparameterized models, the value of the training loss provides few guarantees on model generalization ability. Indeed, optimizing only the training loss value, as is commonly done, can easily lead to suboptimal model quality. Motivated by the connection between geometry of the loss landscape and generalization---including a generalization bound that we prove here---we introduce a novel, effective procedure for instead simultaneously minimizing loss value and loss sharpness. In particular, our procedure, Sharpness-Aware Minimization (SAM), seeks parameters that lie in neighborhoods having uniformly low loss; this formulation results in a min-max optimization problem on which gradient descent can be performed efficiently. We present empirical results showing that SAM improves model generalization across a variety of benchmark datasets (e.g., CIFAR-{10, 100}, ImageNet, finetuning tasks) and models, yielding novel state-of-the-art performance for several. Additionally, we find that SAM natively provides robustness to label noise on par with that provided by state-of-the-art procedures that specifically target learning with noisy labels.

Spotlight
On the Universality of Rotation Equivariant Point Cloud Networks

Nadav Dym, Haggai Maron

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Learning functions on point clouds has applications in many fields, including computer vision, computer graphics, physics, and chemistry. Recently, there has been a growing interest in neural architectures that are invariant or equivariant to all three shape-preserving transformations of point clouds: translation, rotation, and permutation. In this paper, we present a first study of the approximation power of these architectures. We first derive two sufficient conditions for an equivariant architecture to have the universal approximation property, based on a novel characterization of the space of equivariant polynomials. We then use these conditions to show that two recently suggested models, Tensor field Networks and SE3-Transformers, are universal, and for devising two other novel universal architectures.

Poster
DOP: Off-Policy Multi-Agent Decomposed Policy Gradients

Yihan Wang, Beining Han, Tonghan Wang, Heng Dong, Chongjie Zhang

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Multi-agent policy gradient (MAPG) methods recently witness vigorous progress. However, there is a significant performance discrepancy between MAPG methods and state-of-the-art multi-agent value-based approaches. In this paper, we investigate causes that hinder the performance of MAPG algorithms and present a multi-agent decomposed policy gradient method (DOP). This method introduces the idea of value function decomposition into the multi-agent actor-critic framework. Based on this idea, DOP supports efficient off-policy learning and addresses the issue of centralized-decentralized mismatch and credit assignment in both discrete and continuous action spaces. We formally show that DOP critics have sufficient representational capability to guarantee convergence. In addition, empirical evaluations on the StarCraft II micromanagement benchmark and multi-agent particle environments demonstrate that DOP outperforms both state-of-the-art value-based and policy-based multi-agent reinforcement learning algorithms. Demonstrative videos are available at https://sites.google.com/view/dop-mapg/.

Poster
Graph Traversal with Tensor Functionals: A Meta-Algorithm for Scalable Learning

Elan Sopher Markowitz, Keshav Balasubramanian, Mehrnoosh Mirtaheri, Sami Abu-El-Haija, Bryan Perozzi, Greg Ver Steeg, Aram Galstyan

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Graph Representation Learning (GRL) methods have impacted fields from chemistry to social science. However, their algorithmic implementations are specialized to specific use-cases e.g. "message passing" methods are run differently from "node embedding" ones. Despite their apparent differences, all these methods utilize the graph structure, and therefore, their learning can be approximated with stochastic graph traversals. We propose Graph Traversal via Tensor Functionals (GTTF), a unifying meta-algorithm framework for easing the implementation of diverse graph algorithms and enabling transparent and efficient scaling to large graphs. GTTF is founded upon a data structure (stored as a sparse tensor) and a stochastic graph traversal algorithm (described using tensor operations). The algorithm is a functional that accept two functions, and can be specialized to obtain a variety of GRL models and objectives, simply by changing those two functions. We show for a wide class of methods, our algorithm learns in an unbiased fashion and, in expectation, approximates the learning as if the specialized implementations were run directly. With these capabilities, we scale otherwise non-scalable methods to set state-of-the-art on large graph datasets while being more efficient than existing GRL libraries -- with only a handful of lines of code for each method specialization.

Poster
Partitioned Learned Bloom Filters

Kapil Vaidya, Eric Knorr, Michael Mitzenmacher, Tim Kraska

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Bloom filters are space-efficient probabilistic data structures that are used to test whether an element is a member of a set, and may return false positives. Recently, variations referred to as learned Bloom filters were developed that can provide improved performance in terms of the rate of false positives, by using a learned model for the represented set. However, previous methods for learned Bloom filters do not take full advantage of the learned model. Here we show how to frame the problem of optimal model utilization as an optimization problem, and using our framework derive algorithms that can achieve near-optimal performance in many cases.

Poster
Meta-learning with negative learning rates

Alberto Bernacchia

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Deep learning models require a large amount of data to perform well. When data is scarce for a target task, we can transfer the knowledge gained by training on similar tasks to quickly learn the target. A successful approach is meta-learning, or "learning to learn" a distribution of tasks, where "learning" is represented by an outer loop, and "to learn" by an inner loop of gradient descent. However, a number of recent empirical studies argue that the inner loop is unnecessary and more simple models work equally well or even better. We study the performance of MAML as a function of the learning rate of the inner loop, where zero learning rate implies that there is no inner loop. Using random matrix theory and exact solutions of linear models, we calculate an algebraic expression for the test loss of MAML applied to mixed linear regression and nonlinear regression with overparameterized models. Surprisingly, while the optimal learning rate for adaptation is positive, we find that the optimal learning rate for training is always negative, a setting that has never been considered before. Therefore, not only does the performance increase by decreasing the learning rate to zero, as suggested by recent work, but it can be increased even further by decreasing the learning rate to negative values. These results help clarify under what circumstances meta-learning performs best.

Poster
VAEBM: A Symbiosis between Variational Autoencoders and Energy-based Models

Zhisheng Xiao, Karsten Kreis, Jan Kautz, Arash Vahdat

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Energy-based models (EBMs) have recently been successful in representing complex distributions of small images. However, sampling from them requires expensive Markov chain Monte Carlo (MCMC) iterations that mix slowly in high dimensional pixel space. Unlike EBMs, variational autoencoders (VAEs) generate samples quickly and are equipped with a latent space that enables fast traversal of the data manifold. However, VAEs tend to assign high probability density to regions in data space outside the actual data distribution and often fail at generating sharp images. In this paper, we propose VAEBM, a symbiotic composition of a VAE and an EBM that offers the best of both worlds. VAEBM captures the overall mode structure of the data distribution using a state-of-the-art VAE and it relies on its EBM component to explicitly exclude non-data-like regions from the model and refine the image samples. Moreover, the VAE component in VAEBM allows us to speed up MCMC updates by reparameterizing them in the VAE's latent space. Our experimental results show that VAEBM outperforms state-of-the-art VAEs and EBMs in generative quality on several benchmark image datasets by a large margin. It can generate high-quality images as large as 256$\times$256 pixels with short MCMC chains. We also demonstrate that VAEBM provides complete mode coverage and performs well in out-of-distribution detection.

Spotlight
Enforcing robust control guarantees within neural network policies

Priya L. Donti, Melrose Roderick, Mahyar Fazlyab, J Zico Kolter

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When designing controllers for safety-critical systems, practitioners often face a challenging tradeoff between robustness and performance. While robust control methods provide rigorous guarantees on system stability under certain worst-case disturbances, they often yield simple controllers that perform poorly in the average (non-worst) case. In contrast, nonlinear control methods trained using deep learning have achieved state-of-the-art performance on many control tasks, but often lack robustness guarantees. In this paper, we propose a technique that combines the strengths of these two approaches: constructing a generic nonlinear control policy class, parameterized by neural networks, that nonetheless enforces the same provable robustness criteria as robust control. Specifically, our approach entails integrating custom convex-optimization-based projection layers into a neural network-based policy. We demonstrate the power of this approach on several domains, improving in average-case performance over existing robust control methods and in worst-case stability over (non-robust) deep RL methods.

Poster
Spatially Structured Recurrent Modules

Nasim Rahaman, Anirudh Goyal, Muhammad Waleed Gondal, Manuel Wuthrich, Stefan Bauer, Yash Sharma, Yoshua Bengio, Bernhard Schölkopf

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Capturing the structure of a data-generating process by means of appropriate inductive biases can help in learning models that generalise well and are robust to changes in the input distribution. While methods that harness spatial and temporal structures find broad application, recent work has demonstrated the potential of models that leverage sparse and modular structure using an ensemble of sparingly interacting modules. In this work, we take a step towards dynamic models that are capable of simultaneously exploiting both modular and spatiotemporal structures. To this end, we model the dynamical system as a collection of autonomous but sparsely interacting sub-systems that interact according to a learned topology which is informed by the spatial structure of the underlying system. This gives rise to a class of models that are well suited for capturing the dynamics of systems that only offer local views into their state, along with corresponding spatial locations of those views. On the tasks of video prediction from cropped frames and multi-agent world modelling from partial observations in the challenging Starcraft2 domain, we find our models to be more robust to the number of available views and better capable of generalisation to novel tasks without additional training than strong baselines that perform equally well or better on the training distribution.

Poster
Autoregressive Entity Retrieval

Nicola De Cao, Gautier Izacard, Sebastian Riedel, Fabio Petroni

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Entities are at the center of how we represent and aggregate knowledge. For instance, Encyclopedias such as Wikipedia are structured by entities (e.g., one per Wikipedia article). The ability to retrieve such entities given a query is fundamental for knowledge-intensive tasks such as entity linking and open-domain question answering. One way to understand current approaches is as classifiers among atomic labels, one for each entity. Their weight vectors are dense entity representations produced by encoding entity meta information such as their descriptions. This approach leads to several shortcomings: (i) context and entity affinity is mainly captured through a vector dot product, potentially missing fine-grained interactions between the two; (ii) a large memory footprint is needed to store dense representations when considering large entity sets; (iii) an appropriately hard set of negative data has to be subsampled at training time. In this work, we propose GENRE, the first system that retrieves entities by generating their unique names, left to right, token-by-token in an autoregressive fashion and conditioned on the context. This enables us to mitigate the aforementioned technical issues since: (i) the autoregressive formulation allows us to directly capture relations between context and entity name, effectively cross encoding both; (ii) the memory footprint is greatly reduced because the parameters of our encoder-decoder architecture scale with vocabulary size, not entity count; (iii) the exact softmax loss can be efficiently computed without the need to subsample negative data. We show the efficacy of the approach, experimenting with more than 20 datasets on entity disambiguation, end-to-end entity linking and document retrieval tasks, achieving new state-of-the-art or very competitive results while using a tiny fraction of the memory footprint of competing systems. Finally, we demonstrate that new entities can be added by simply specifying their unambiguous name. Code and pre-trained models at https://github.com/facebookresearch/GENRE.

Spotlight
Loss Function Discovery for Object Detection via Convergence-Simulation Driven Search

Peidong Liu, Gengwei Zhang, Bochao Wang, Hang Xu, Xiaodan Liang, Yong Jiang, Zhenguo Li

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Designing proper loss functions for vision tasks has been a long-standing research direction to advance the capability of existing models. For object detection, the well-established classification and regression loss functions have been carefully designed by considering diverse learning challenges (e.g. class imbalance, hard negative samples, and scale variances). Inspired by the recent progress in network architecture search, it is interesting to explore the possibility of discovering new loss function formulations via directly searching the primitive operation combinations. So that the learned losses not only fit for diverse object detection challenges to alleviate huge human efforts, but also have better alignment with evaluation metric and good mathematical convergence property. Beyond the previous auto-loss works on face recognition and image classification, our work makes the first attempt to discover new loss functions for the challenging object detection from primitive operation levels and finds the searched losses are insightful. We propose an effective convergence-simulation driven evolutionary search algorithm, called CSE-Autoloss, for speeding up the search progress by regularizing the mathematical rationality of loss candidates via two progressive convergence simulation modules: convergence property verification and model optimization simulation. CSE-Autoloss involves the search space (i.e. 21 mathematical operators, 3 constant-type inputs, and 3 variable-type inputs) that cover a wide range of the possible variants of existing losses and discovers best-searched loss function combination within a short time (around 1.5 wall-clock days with 20x speedup in comparison to the vanilla evolutionary algorithm). We conduct extensive evaluations of loss function search on popular detectors and validate the good generalization capability of searched losses across diverse architectures and various datasets. Our experiments show that the best-discovered loss function combinations outperform default combinations (Cross-entropy/Focal loss for classification and L1 loss for regression) by 1.1% and 0.8% in terms of mAP for two-stage and one-stage detectors on COCO respectively. Our searched losses are available at https://github.com/PerdonLiu/CSE-Autoloss.

Poster
Empirical Analysis of Unlabeled Entity Problem in Named Entity Recognition

Yangming Li, lemao liu, Shuming Shi

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In many scenarios, named entity recognition (NER) models severely suffer from unlabeled entity problem, where the entities of a sentence may not be fully annotated. Through empirical studies performed on synthetic datasets, we find two causes of performance degradation. One is the reduction of annotated entities and the other is treating unlabeled entities as negative instances. The first cause has less impact than the second one and can be mitigated by adopting pretraining language models. The second cause seriously misguides a model in training and greatly affects its performances. Based on the above observations, we propose a general approach, which can almost eliminate the misguidance brought by unlabeled entities. The key idea is to use negative sampling that, to a large extent, avoids training NER models with unlabeled entities. Experiments on synthetic datasets and real-world datasets show that our model is robust to unlabeled entity problem and surpasses prior baselines. On well-annotated datasets, our model is competitive with the state-of-the-art method.

Poster
Generalized Multimodal ELBO

Thomas M. Sutter, Imant Daunhawer, Julia E Vogt

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Multiple data types naturally co-occur when describing real-world phenomena and learning from them is a long-standing goal in machine learning research. However, existing self-supervised generative models approximating an ELBO are not able to fulfill all desired requirements of multimodal models: their posterior approximation functions lead to a trade-off between the semantic coherence and the ability to learn the joint data distribution. We propose a new, generalized ELBO formulation for multimodal data that overcomes these limitations. The new objective encompasses two previous methods as special cases and combines their benefits without compromises. In extensive experiments, we demonstrate the advantage of the proposed method compared to state-of-the-art models in self-supervised, generative learning tasks.

Poster
Learning Better Structured Representations Using Low-rank Adaptive Label Smoothing

Asish Ghoshal, Xilun Chen, Sonal Gupta, Luke Zettlemoyer, Yashar Mehdad

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Training with soft targets instead of hard targets has been shown to improve performance and calibration of deep neural networks. Label smoothing is a popular way of computing soft targets, where one-hot encoding of a class is smoothed with a uniform distribution. Owing to its simplicity, label smoothing has found wide-spread use for training deep neural networks on a wide variety of tasks, ranging from image and text classification to machine translation and semantic parsing. Complementing recent empirical justification for label smoothing, we obtain PAC-Bayesian generalization bounds for label smoothing and show that the generalization error depends on the choice of the noise (smoothing) distribution. Then we propose low-rank adaptive label smoothing (LORAS): a simple yet novel method for training with learned soft targets that generalizes label smoothing and adapts to the latent structure of the label space in structured prediction tasks. Specifically, we evaluate our method on semantic parsing tasks and show that training with appropriately smoothed soft targets can significantly improve accuracy and model calibration, especially in low-resource settings. Used in conjunction with pre-trained sequence-to-sequence models, our method achieves state of the art performance on four semantic parsing data sets. LORAS can be used with any model, improves performance and implicit model calibration without increasing the number of model parameters, and can be scaled to problems with large label spaces containing tens of thousands of labels.

Poster
Colorization Transformer

Manoj Kumar, Dirk Weissenborn, Nal Kalchbrenner

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We present the Colorization Transformer, a novel approach for diverse high fidelity image colorization based on self-attention. Given a grayscale image, the colorization proceeds in three steps. We first use a conditional autoregressive transformer to produce a low resolution coarse coloring of the grayscale image. Our architecture adopts conditional transformer layers to effectively condition grayscale input. Two subsequent fully parallel networks upsample the coarse colored low resolution image into a finely colored high resolution image. Sampling from the Colorization Transformer produces diverse colorings whose fidelity outperforms the previous state-of-the-art on colorising ImageNet based on FID results and based on a human evaluation in a Mechanical Turk test. Remarkably, in more than 60\% of cases human evaluators prefer the highest rated among three generated colorings over the ground truth. The code and pre-trained checkpoints for Colorization Transformer are publicly available at https://github.com/google-research/google-research/tree/master/coltran

Poster
Scalable Bayesian Inverse Reinforcement Learning

Alex James Chan, Mihaela van der Schaar

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Bayesian inference over the reward presents an ideal solution to the ill-posed nature of the inverse reinforcement learning problem. Unfortunately current methods generally do not scale well beyond the small tabular setting due to the need for an inner-loop MDP solver, and even non-Bayesian methods that do themselves scale often require extensive interaction with the environment to perform well, being inappropriate for high stakes or costly applications such as healthcare. In this paper we introduce our method, Approximate Variational Reward Imitation Learning (AVRIL), that addresses both of these issues by jointly learning an approximate posterior distribution over the reward that scales to arbitrarily complicated state spaces alongside an appropriate policy in a completely offline manner through a variational approach to said latent reward. Applying our method to real medical data alongside classic control simulations, we demonstrate Bayesian reward inference in environments beyond the scope of current methods, as well as task performance competitive with focused offline imitation learning algorithms.

Poster