mtybilly/Instruct2DS huggingface dataset:
A Temporal Kernel Approach for Deep Learning with Continuous-time Information
Authors: Da Xu, Chuanwei Ruan, Evren Korpeoglu, Sushant Kumar, Kannan Achan
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Sequential deep learning models such as RNN, causal CNN and attention mechanism do not readily consume continuous-time information. Discretizing the temporal data, as we show, causes inconsistency even for simple continuous-time processes. Current approaches often handle time in a heuristic manner to be consistent with the existing deep learning architectures and implementations. In this paper, we provide a principled way to characterize continuous-time systems using deep learning tools. Notably, the proposed approach applies to all the major deep learning architectures and requires little modifications to the implementation. The critical insight is to represent the continuous-time system by composing neural networks with a temporal kernel, where we gain our intuition from the recent advancements in understanding deep learning with Gaussian process and neural tangent kernel. To represent the temporal kernel, we introduce the random feature approach and convert the kernel learning problem to spectral density estimation under reparameterization. We further prove the convergence and consistency results even when the temporal kernel is non-stationary, and the spectral density is misspecified. The simulations and real-data experiments demonstrate the empirical effectiveness of our temporal kernel approach in a broad range of settings.
Growing Efficient Deep Networks by Structured Continuous Sparsification
Authors: Xin Yuan, Pedro Henrique Pamplona Savarese, Michael Maire
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: We develop an approach to growing deep network architectures over the course of training, driven by a principled combination of accuracy and sparsity objectives.  Unlike existing pruning or architecture search techniques that operate on full-sized models or supernet architectures, our method can start from a small, simple seed architecture and dynamically grow and prune both layers and filters.  By combining a continuous relaxation of discrete network structure optimization with a scheme for sampling sparse subnetworks, we produce compact, pruned networks, while also drastically reducing the computational expense of training.  For example, we achieve $49.7\%$ inference FLOPs and $47.4\%$ training FLOPs savings compared to a baseline ResNet-50 on ImageNet, while maintaining $75.2\%$ top-1 validation accuracy --- all without any dedicated fine-tuning stage.  Experiments across CIFAR, ImageNet, PASCAL VOC, and Penn Treebank, with convolutional networks for image classification and semantic segmentation, and recurrent networks for language modeling, demonstrate that we both train faster and produce more efficient networks than competing architecture pruning or search methods.
Watch-And-Help: A Challenge for Social Perception and Human-AI Collaboration
Authors: Xavier Puig, Tianmin Shu, Shuang Li, Zilin Wang, Yuan-Hong Liao, Joshua B. Tenenbaum, Sanja Fidler, Antonio Torralba
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: In this paper, we introduce Watch-And-Help (WAH), a challenge for testing social intelligence in agents. In WAH, an AI agent needs to help a human-like agent perform a complex household task efficiently. To succeed, the AI agent needs to i) understand the underlying goal of the task by watching a single demonstration of the human-like agent performing the same task (social perception), and ii) coordinate with the human-like agent to solve the task in an unseen environment as fast as possible (human-AI collaboration). For this challenge, we build VirtualHome-Social, a multi-agent household environment, and provide a benchmark including both planning and learning based baselines. We evaluate the performance of AI agents with the human-like agent as well as and with real humans using objective metrics and subjective user ratings. Experimental results demonstrate that our challenge and virtual environment enable a systematic evaluation on the important aspects of machine social intelligence at scale.
A Diffusion Theory For Deep Learning Dynamics: Stochastic Gradient Descent Exponentially Favors Flat Minima
Authors: Zeke Xie, Issei Sato, Masashi Sugiyama
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Stochastic Gradient Descent (SGD) and its variants are mainstream methods for training deep networks in practice. SGD is known to find a flat minimum that often generalizes well. However, it is mathematically unclear how deep learning can select a flat minimum among so many minima. To answer the question quantitatively, we develop a density diffusion theory to reveal how minima selection quantitatively depends on the minima sharpness and the hyperparameters. To the best of our knowledge, we are the first to theoretically and empirically prove that, benefited from the Hessian-dependent covariance of stochastic gradient noise, SGD favors flat minima exponentially more than sharp minima, while Gradient Descent (GD) with injected white noise favors flat minima only polynomially more than sharp minima. We also reveal that either a small learning rate or large-batch training requires exponentially many iterations to escape from minima in terms of the ratio of the batch size and learning rate. Thus, large-batch training cannot search flat minima efficiently in a realistic computational time.
MONGOOSE: A Learnable LSH Framework for Efficient Neural Network Training
Authors: Beidi Chen, Zichang Liu, Binghui Peng, Zhaozhuo Xu, Jonathan Lingjie Li, Tri Dao, Zhao Song, Anshumali Shrivastava, Christopher Re
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Recent advances by practitioners in the deep learning community have breathed new life into Locality Sensitive Hashing (LSH), using it to reduce memory and time bottlenecks in neural network (NN) training. However, while LSH has sub-linear guarantees for approximate near-neighbor search in theory, it is known to have inefficient query time in practice due to its use of random hash functions. Moreover, when model parameters are changing, LSH suffers from update overhead. This work is motivated by an observation that model parameters evolve slowly, such that the changes do not always require an LSH update to maintain performance. This phenomenon points to the potential for a reduction in update time and allows for a modified learnable version of data-dependent LSH to improve query time at a low cost. We use the above insights to build MONGOOSE, an end-to-end LSH framework for efficient NN training. In particular, MONGOOSE is equipped with a scheduling algorithm to adaptively perform LSH updates with provable guarantees and learnable hash functions to improve query efficiency. Empirically, we validate MONGOOSE on large-scale deep learning models for recommendation systems and language modeling. We find that it achieves up to 8% better accuracy compared to previous LSH approaches, with $6.5 \times$ speed-up and $6\times$ reduction in memory usage.
Meta-GMVAE: Mixture of Gaussian VAE for Unsupervised Meta-Learning
Authors: Dong Bok Lee, Dongchan Min, Seanie Lee, Sung Ju Hwang
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Unsupervised learning aims to learn meaningful representations from unlabeled data which can captures its intrinsic structure, that can be transferred to downstream tasks. Meta-learning, whose objective is to learn to generalize across tasks such that the learned model can rapidly adapt to a novel task, shares the spirit of unsupervised learning in that the both seek to learn more effective and efficient learning procedure than learning from scratch. The fundamental difference of the two is that the most meta-learning approaches are supervised, assuming full access to the labels. However, acquiring labeled dataset for meta-training not only is costly as it requires human efforts in labeling but also limits its applications to pre-defined task distributions. In this paper, we propose a principled unsupervised meta-learning model, namely Meta-GMVAE, based on Variational Autoencoder (VAE) and set-level variational inference. Moreover, we introduce a mixture of Gaussian (GMM) prior, assuming that each modality represents each class-concept in a randomly sampled episode, which we optimize with Expectation-Maximization (EM). Then, the learned model can be used for downstream few-shot classification tasks, where we obtain task-specific parameters by performing semi-supervised EM on the latent representations of the support and query set, and predict labels of the query set by computing aggregated posteriors. We validate our model on Omniglot and Mini-ImageNet datasets by evaluating its performance on downstream few-shot classification tasks. The results show that our model obtain impressive performance gains over existing unsupervised meta-learning baselines, even outperforming supervised MAML on a certain setting.
Capturing Label Characteristics in VAEs
Authors: Tom Joy, Sebastian Schmon, Philip Torr, Siddharth N, Tom Rainforth
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: We present a principled approach to incorporating labels in variational autoencoders (VAEs) that captures the rich characteristic information associated with those labels. While prior work has typically conflated these by learning latent variables that directly correspond to label values, we argue this is contrary to the intended effect of supervision in VAEs—capturing rich label characteristics with the latents. For example, we may want to capture the characteristics of a face that make it look young, rather than just the age of the person. To this end, we develop a novel VAE model, the characteristic capturing VAE (CCVAE), which “reparameterizes” supervision through auxiliary variables and a concomitant variational objective. Through judicious structuring of mappings between latent and auxiliary variables, we show that the CCVAE can effectively learn meaningful representations of the characteristics of interest across a variety of supervision schemes. In particular, we show that the CCVAE allows for more effective and more general interventions to be performed, such as smooth traversals within the characteristics for a given label, diverse conditional generation, and transferring characteristics across datapoints.
Fast convergence of stochastic subgradient method under interpolation
Authors: Huang Fang, Zhenan Fan, Michael Friedlander
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: This paper studies the behaviour of the stochastic subgradient descent (SSGD) method applied to over-parameterized nonsmooth optimization problems that satisfy an interpolation condition. By leveraging the composite structure of the empirical risk minimization problems, we prove that SSGD converges, respectively, with rates $O(1/\epsilon)$ and $O(\log(1/\epsilon))$ for convex and strongly-convex objectives when interpolation holds. These rates coincide with established rates for the stochastic gradient descent (SGD) method applied to smooth problems that also satisfy an interpolation condition. Our analysis provides a partial explanation for the empirical observation that sometimes SGD and SSGD behave similarly for training smooth and nonsmooth machine learning models. We also prove that the rate $O(1/\epsilon)$ is optimal for the subgradient method in the convex and interpolation setting.
Plan-Based Relaxed Reward Shaping for Goal-Directed Tasks
Authors: Ingmar Schubert, Ozgur S Oguz, Marc Toussaint
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: In high-dimensional state spaces, the usefulness of Reinforcement Learning (RL) is limited by the problem of exploration. This issue has been addressed using potential-based reward shaping (PB-RS) previously. In the present work, we introduce Final-Volume-Preserving Reward Shaping (FV-RS). FV-RS relaxes the strict optimality guarantees of PB-RS to a guarantee of preserved long-term behavior. Being less restrictive, FV-RS allows for reward shaping functions that are even better suited for improving the sample efficiency of RL algorithms. In particular, we consider settings in which the agent has access to an approximate plan. Here, we use examples of simulated robotic manipulation tasks to demonstrate that plan-based FV-RS can indeed significantly improve the sample efficiency of RL over plan-based PB-RS.
Physics-aware, probabilistic model order reduction with guaranteed stability
Authors: Sebastian Kaltenbach, Phaedon Stelios Koutsourelakis
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Given (small amounts of) time-series' data from  a high-dimensional, fine-grained, multiscale dynamical system, we propose a generative framework for learning an effective, lower-dimensional, coarse-grained dynamical model that is predictive of the fine-grained system's long-term evolution but also of its behavior under different initial conditions.
We target fine-grained models as they arise in physical applications (e.g. molecular dynamics, agent-based models), the dynamics  of which are strongly non-stationary but their transition to equilibrium is governed by unknown slow processes which are largely inaccessible by brute-force simulations.
Approaches based on domain knowledge heavily rely on physical insight in identifying temporally slow features and fail to enforce the long-term stability of the learned dynamics. On the other hand, purely statistical frameworks lack interpretability and rely on large amounts of expensive simulation data (long and multiple trajectories) as they cannot infuse domain knowledge. 
The generative framework proposed achieves  the aforementioned desiderata by  employing a flexible prior on the complex plane for the latent, slow processes, and  an intermediate layer of physics-motivated latent variables that reduces reliance on data and imbues inductive bias. In contrast to existing schemes, it does not require  the a priori definition of projection operators from the fine-grained description and addresses simultaneously the tasks of dimensionality reduction and model estimation.
We demonstrate its efficacy and accuracy in multiscale physical systems of particle dynamics where probabilistic, long-term predictions of phenomena not contained in the training data are produced.
Attentional Constellation Nets for Few-Shot Learning
Authors: Weijian Xu, yifan xu, Huaijin Wang, Zhuowen Tu
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: The success of deep convolutional neural networks builds on top of the learning of effective convolution operations, capturing a hierarchy of structured features via filtering, activation, and pooling. However, the explicit structured features, e.g. object parts, are not expressive in the existing CNN frameworks. In this paper, we tackle the few-shot learning problem and make an effort to enhance structured features by expanding CNNs with a constellation model, which performs cell feature clustering and encoding with a dense part representation; the relationships among the cell features are further modeled by an attention mechanism. With the additional constellation branch to increase the awareness of object parts, our method is able to attain the advantages of the CNNs while making the overall internal representations more robust in the few-shot learning setting. Our approach attains a significant improvement over the existing methods in few-shot learning on the CIFAR-FS, FC100, and mini-ImageNet benchmarks.
Shapley Explanation Networks
Authors: Rui Wang, Xiaoqian Wang, David I. Inouye
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Shapley values have become one of the most popular feature attribution explanation methods. However, most prior work has focused on post-hoc Shapley explanations, which can be computationally demanding due to its exponential time complexity and preclude model regularization based on Shapley explanations during training. Thus, we propose to incorporate Shapley values themselves as latent representations in deep models thereby making Shapley explanations first-class citizens in the modeling paradigm. This intrinsic explanation approach enables layer-wise explanations, explanation regularization of the model during training, and fast explanation computation at test time. We define the Shapley transform that transforms the input into a Shapley representation given a specific function. We operationalize the Shapley transform as a neural network module and construct both shallow and deep networks, called ShapNets, by composing Shapley modules. We prove that our Shallow ShapNets compute the exact Shapley values and our Deep ShapNets maintain the missingness and accuracy properties of Shapley values. We demonstrate on synthetic and real-world datasets that our ShapNets enable layer-wise Shapley explanations, novel Shapley regularizations during training, and fast computation while maintaining reasonable performance. Code is available at https://github.com/inouye-lab/ShapleyExplanationNetworks.
Relating by Contrasting: A Data-efficient Framework for Multimodal Generative Models
Authors: Yuge Shi, Brooks Paige, Philip Torr, Siddharth N
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Multimodal learning for generative models often refers to the learning of abstract concepts from the commonality of information in multiple modalities, such as vision and language. While it has proven effective for learning generalisable representations, the training of such models often requires a large amount of related multimodal data that shares commonality, which can be expensive to come by. To mitigate this, we develop a novel contrastive framework for generative model learning, allowing us to train the model not just by the commonality between modalities, but by the distinction between "related" and "unrelated" multimodal data. We show in experiments that our method enables data-efficient multimodal learning on challenging datasets for various multimodal VAE models. We also show that under our proposed framework, the generative model can accurately identify related samples from unrelated ones, making it possible to make use of the plentiful unlabeled, unpaired multimodal data.
Learning Task Decomposition with Ordered Memory Policy Network
Authors: Yuchen Lu, Yikang Shen, Siyuan Zhou, Aaron Courville, Joshua B. Tenenbaum, Chuang Gan
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Many complex real-world tasks are composed of several levels of subtasks. Humans leverage these hierarchical structures to accelerate the learning process and achieve better generalization. In this work, we study the inductive bias and propose Ordered Memory Policy Network (OMPN) to discover subtask hierarchy by learning from demonstration. The discovered subtask hierarchy could be used to perform task decomposition, recovering the subtask boundaries in an unstructured demonstration. Experiments on Craft and Dial demonstrate that our model can achieve higher task decomposition performance under both unsupervised and weakly supervised settings, comparing with strong baselines. OMPN can also be directly applied to partially observable environments and still achieve higher task decomposition performance. Our visualization further confirms that the subtask hierarchy can emerge in our model 1.
Learning Energy-Based Models by Diffusion Recovery Likelihood
Authors: Ruiqi Gao, Yang Song, Ben Poole, Ying Nian Wu, Diederik P Kingma
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: While energy-based models (EBMs) exhibit a number of desirable properties, training and sampling on high-dimensional datasets remains challenging. Inspired by recent progress on diffusion probabilistic models, we present a diffusion recovery likelihood method to tractably learn and sample from a sequence of EBMs trained on increasingly noisy versions of a dataset. Each EBM is trained with recovery likelihood,  which maximizes the conditional probability of the data at a certain noise level given their noisy versions at a higher noise level. Optimizing recovery likelihood is more tractable than marginal likelihood, as sampling from the conditional distributions is much easier than sampling from the marginal distributions. After training, synthesized images can be generated by the sampling process that initializes from Gaussian white noise distribution and progressively samples the conditional distributions at decreasingly lower noise levels.  Our method generates high fidelity samples on various image datasets. On unconditional CIFAR-10 our method achieves FID 9.58 and inception score 8.30, superior to the majority of GANs. Moreover, we demonstrate that unlike previous work on EBMs, our long-run MCMC samples from the conditional distributions do not diverge and still represent realistic images, allowing us to accurately estimate the normalized density of data even for high-dimensional datasets. Our implementation is available at \url{https://github.com/ruiqigao/recovery_likelihood}.
Training BatchNorm and Only BatchNorm: On the Expressive Power of Random Features in CNNs
Authors: Jonathan Frankle, David J. Schwab, Ari S. Morcos
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: A wide variety of deep learning techniques from style transfer to multitask learning rely on training affine transformations of features. Most prominent among these is the popular feature normalization technique BatchNorm, which normalizes activations and then subsequently applies a learned affine transform. In this paper, we aim to understand the role and expressive power of affine parameters used to transform features in this way. To isolate the contribution of these parameters from that of the learned features they transform, we investigate the performance achieved when training only these parameters in BatchNorm and freezing all weights at their random initializations. Doing so leads to surprisingly high performance considering the significant limitations that this style of training imposes. For example, sufficiently deep ResNets reach 82% (CIFAR-10) and 32% (ImageNet, top-5) accuracy in this configuration, far higher than when training an equivalent number of randomly chosen parameters elsewhere in the network. BatchNorm achieves this performance in part by naturally learning to disable around a third of the random features. Not only do these results highlight the expressive power of affine parameters in deep learning, but - in a broader sense - they characterize the expressive power of neural networks constructed simply by shifting and rescaling random features.
A Better Alternative to Error Feedback for Communication-Efficient Distributed Learning
Authors: Samuel Horváth, Peter Richtarik
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Modern large-scale machine learning applications require stochastic optimization algorithms to be implemented on distributed computing systems. A key bottleneck of such systems is the communication overhead for exchanging information across the workers, such as stochastic gradients. Among the many techniques proposed to remedy this issue, one of the most successful is the framework of compressed communication with error feedback (EF). EF remains the only known technique that can deal with the error induced by contractive compressors which are not unbiased, such as Top-$K$ or PowerSGD.  In this paper, we propose a new and theoretically and practically better alternative to EF for dealing with contractive compressors. In particular, we propose a construction which can transform any contractive compressor into an induced unbiased compressor. Following this transformation, existing methods able to work with unbiased compressors can be applied. We show that our approach leads to vast improvements over EF, including reduced memory requirements, better communication complexity guarantees and fewer assumptions. We further extend our results to federated learning with partial participation following an arbitrary distribution over the nodes and demonstrate the benefits thereof. We perform several numerical experiments which validate our theoretical findings.
Robust Pruning at Initialization
Authors: Soufiane Hayou, Jean-Francois Ton, Arnaud Doucet, Yee Whye Teh
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Overparameterized Neural Networks (NN) display state-of-the-art performance. However, there is a growing need for smaller, energy-efficient, neural networks to be able to use machine learning applications on devices with limited computational resources. A popular approach consists of using pruning techniques. While these techniques have traditionally focused on pruning pre-trained NN (LeCun et al.,1990; Hassibi et al., 1993), recent work by Lee et al. (2018) has shown promising results when pruning at initialization. However, for Deep NNs, such procedures remain unsatisfactory as the resulting pruned networks can be difficult to train and, for instance, they do not prevent one layer from being fully pruned. In this paper, we provide a comprehensive theoretical analysis of Magnitude and Gradient based pruning at initialization and training of sparse architectures.  This allows us to propose novel principled approaches which we validate experimentally on a variety of NN architectures.
A Mathematical Exploration of Why Language Models Help Solve Downstream Tasks
Authors: Nikunj Saunshi, Sadhika Malladi, Sanjeev Arora
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Autoregressive language models, pretrained using large text corpora to do well on next word prediction, have been successful at solving many downstream tasks, even with zero-shot usage. However, there is little theoretical understanding of this success. This paper initiates a mathematical study of this phenomenon for the downstream task of text classification by considering the following questions: (1) What is the intuitive connection between the pretraining task of next word prediction and text classification? (2) How can we mathematically formalize this connection and quantify the benefit of language modeling? For (1), we hypothesize, and verify empirically, that classification tasks of interest can be reformulated as sentence completion tasks, thus making language modeling a meaningful pretraining task. With a mathematical formalization of this hypothesis, we make progress towards (2) and show that language models that are $\epsilon$-optimal in cross-entropy (log-perplexity) learn features that can linearly solve such classification tasks with $\mathcal{O}(\sqrt{\epsilon})$ error, thus demonstrating that doing well on language modeling can be beneficial for downstream tasks. We experimentally verify various assumptions and theoretical findings, and also use insights from the analysis to design a new objective function that performs well on some classification tasks.
Learnable Embedding sizes for Recommender Systems
Authors: Siyi Liu, Chen Gao, Yihong Chen, Depeng Jin, Yong Li
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: The embedding-based representation learning is commonly used in deep learning recommendation models to map the raw sparse features to dense vectors. The traditional embedding manner that assigns a uniform size to all features has two issues. First, the numerous features inevitably lead to a gigantic embedding table that causes a high memory usage cost. Second, it is likely to cause the over-fitting problem for those features that do not require too large representation capacity. Existing works that try to address the problem always cause a significant drop in recommendation performance or suffers from the limitation of unaffordable training time cost. In this paper, we proposed a novel approach, named PEP (short for Plug-in Embedding Pruning), to reduce the size of the embedding table while avoiding the drop of recommendation accuracy. PEP prunes embedding parameter where the pruning threshold(s) can be adaptively learned from data. Therefore we can automatically obtain a mixed-dimension embedding-scheme by pruning redundant parameters for each feature. PEP is a general framework that can plug in various base recommendation models. Extensive experiments demonstrate it can efficiently cut down embedding parameters and boost the base model's performance. Specifically, it achieves strong recommendation performance while reducing 97-99% parameters. As for the computation cost, PEP only brings an additional 20-30% time cost compare with base models.
PDE-Driven Spatiotemporal Disentanglement
Authors: Jérémie Donà, Jean-Yves Franceschi, sylvain lamprier, patrick gallinari
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: A recent line of work in the machine learning community addresses the problem of predicting high-dimensional spatiotemporal phenomena by leveraging specific tools from the differential equations theory. Following this direction, we propose in this article a novel and general paradigm for this task based on a resolution method for partial differential equations: the separation of variables. This inspiration allows us to introduce a dynamical interpretation of spatiotemporal disentanglement. It induces a principled model based on learning disentangled spatial and temporal representations of a phenomenon to accurately predict future observations. We experimentally demonstrate the performance and broad applicability of our method against prior state-of-the-art models on physical and synthetic video datasets.
Deep Neural Tangent Kernel and Laplace Kernel Have the Same RKHS
Authors: Lin Chen, Sheng Xu
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: We prove that the reproducing kernel Hilbert spaces (RKHS) of a deep neural tangent kernel and the Laplace kernel include the same set of functions, when both kernels are restricted to the sphere $\mathbb{S}^{d-1}$. Additionally, we prove that the exponential power kernel with a smaller power (making the kernel less smooth) leads to a larger RKHS, when it is restricted to the sphere $\mathbb{S}^{d-1}$ and when it is defined on the entire $\mathbb{R}^d$.
Learning Structural Edits via Incremental Tree Transformations
Authors: Ziyu Yao, Frank F. Xu, Pengcheng Yin, Huan Sun, Graham Neubig
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: While most neural generative models generate outputs in a single pass, the human creative process is usually one of iterative building and refinement. Recent work has proposed models of editing processes, but these mostly focus on editing sequential data and/or only model a single editing pass. In this paper, we present a generic model for incremental editing of structured data (i.e. ''structural edits''). Particularly, we focus on tree-structured data, taking abstract syntax trees of computer programs as our canonical example. Our editor learns to iteratively generate tree edits (e.g. deleting or adding a subtree) and applies them to the partially edited data, thereby the entire editing process can be formulated as consecutive, incremental tree transformations. To show the unique benefits of modeling tree edits directly, we further propose a novel edit encoder for learning to represent edits, as well as an imitation learning method that allows the editor to be more robust. We evaluate our proposed editor on two source code edit datasets, where results show that, with the proposed edit encoder, our editor significantly improves accuracy over previous approaches that generate the edited program directly in one pass. Finally, we demonstrate that training our editor to imitate experts and correct its mistakes dynamically can further improve its performance.
UPDeT: Universal Multi-agent RL via Policy Decoupling with Transformers
Authors: Siyi Hu, Fengda Zhu, Xiaojun Chang, Xiaodan Liang
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Recent advances in multi-agent reinforcement learning have been largely limited in training one model from scratch for every new task. The limitation is due to the restricted model architecture related to fixed input and output dimensions. This hinders the experience accumulation and transfer of the learned agent over tasks with diverse levels of difficulty (e.g. 3 vs 3 or 5 vs 6 multi-agent games).  In this paper, we make the first attempt to explore a universal multi-agent reinforcement learning pipeline, designing one single architecture to fit tasks with the requirement of different observation and action configurations. Unlike previous RNN-based models, we utilize a transformer-based model to generate a flexible policy by decoupling the policy distribution from the intertwined input observation with an importance weight measured by the merits of the self-attention mechanism. Compared to a standard transformer block, the proposed model, named as Universal Policy Decoupling Transformer (UPDeT), further relaxes the action restriction and makes the multi-agent task's decision process more explainable. UPDeT is general enough to be plugged into any multi-agent reinforcement learning pipeline and equip them with strong generalization abilities that enables the handling of multiple tasks at a time. Extensive experiments on large-scale SMAC multi-agent competitive games demonstrate that the proposed UPDeT-based multi-agent reinforcement learning achieves significant results relative to state-of-the-art approaches, demonstrating advantageous transfer capability in terms of both performance and training speed (10 times faster).
Conditional Negative Sampling for Contrastive Learning of Visual Representations
Authors: Mike Wu, Milan Mosse, Chengxu Zhuang, Daniel Yamins, Noah Goodman
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Recent methods for learning unsupervised visual representations, dubbed contrastive learning, optimize the noise-contrastive estimation (NCE) bound on mutual information between two transformations of an image. NCE typically uses randomly sampled negative examples to normalize the objective, but this may often include many uninformative examples either because they are too easy or too hard to discriminate. Taking inspiration from  metric learning, we show that choosing semi-hard negatives can yield stronger contrastive representations. To do this, we introduce a family of mutual information estimators that sample negatives conditionally -- in a "ring" around each positive. We prove that these estimators remain lower-bounds of mutual information, with higher bias but lower variance than NCE. Experimentally, we find our approach, applied on top of existing models (IR, CMC, and MoCo) improves accuracy by 2-5% absolute points in each case, measured by linear evaluation on four standard image benchmarks. Moreover, we find continued benefits when transferring features to a variety of new image distributions from the Meta-Dataset collection and to a variety of downstream tasks such as object detection, instance segmentation, and key-point detection.
SSD: A Unified Framework for Self-Supervised Outlier Detection
Authors: Vikash Sehwag, Mung Chiang, Prateek Mittal
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: We ask the following question: what training information is required to design an effective outlier/out-of-distribution (OOD) detector, i.e., detecting samples that lie far away from training distribution? Since unlabeled data is easily accessible for many applications, the most compelling approach is to develop detectors based on only unlabeled in-distribution data. However, we observe that most existing detectors based on unlabeled data perform poorly, often equivalent to a random prediction. In contrast, existing state-of-the-art OOD detectors achieve impressive performance but require access to fine-grained data labels for supervised training. We propose SSD, an outlier detector based on only unlabeled in-distribution data. We use self-supervised representation learning followed by a Mahalanobis distance based detection in the feature space. We demonstrate that SSD outperforms most existing detectors based on unlabeled data by a large margin. Additionally, SSD even achieves performance on par, and sometimes even better, with supervised training based detectors.  Finally, we expand our detection framework with two key extensions. First, we formulate few-shot OOD detection, in which the detector has access to only one to five samples from each class of the targeted OOD dataset. Second, we extend our framework to incorporate training data labels, if available. We find that our novel detection framework based on SSD displays enhanced performance with these extensions, and achieves state-of-the-art performance. Our code is publicly available at https://github.com/inspire-group/SSD.
One Network Fits All? Modular versus Monolithic Task Formulations in Neural Networks
Authors: Atish Agarwala, Abhimanyu Das, Brendan Juba, Rina Panigrahy, Vatsal Sharan, Xin Wang, Qiuyi Zhang
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Can deep learning solve multiple, very different tasks simultaneously? We investigate how the representations of the underlying tasks affect the ability of a single neural network to learn them jointly. We present theoretical and empirical findings that a single neural network is capable of simultaneously learning multiple tasks from a combined data set, for a variety of methods for representing tasks---for example, when the distinct tasks are encoded by well-separated clusters or decision trees over some task-code attributes. Indeed, more strongly, we present a novel analysis that shows that families of simple programming-like constructs for the codes encoding the tasks are learnable by two-layer neural networks with standard training. We study more generally how the complexity of learning such combined tasks grows with the complexity of the task codes; we find that learning many tasks can be provably hard, even though the individual tasks are easy to learn. We provide empirical support for the usefulness of the learning bounds by training networks on clusters, decision trees, and SQL-style aggregation.
Graph Coarsening with Neural Networks
Authors: Chen Cai, Dingkang Wang, Yusu Wang
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: As large scale-graphs become increasingly more prevalent, it poses significant computational challenges to process, extract and analyze large graph data. Graph coarsening is one popular technique to reduce the size of a graph while maintaining essential properties. Despite rich graph coarsening literature, there is only limited exploration of data-driven method in the field. In this work, we leverage the recent progress of deep learning on graphs for graph coarsening. We first propose a framework for measuring the quality of coarsening algorithm and show that depending on the goal, we need to carefully choose the Laplace operator on the coarse graph and associated projection/lift operators. Motivated by the observation that the current choice of edge weight for the coarse graph may be sub-optimal, we parametrize the weight assignment map with graph neural networks and train it to improve the coarsening quality in an unsupervised way. Through extensive experiments on both synthetic and real networks, we demonstrate that our method significantly improves common graph coarsening methods under various metrics, reduction ratios, graph sizes, and graph types. It generalizes to graphs of larger size (more than $25\times$ of training graphs), adaptive to different losses (both differentiable and non-differentiable), and scales to much larger graphs than previous work.
Explaining by Imitating: Understanding Decisions by Interpretable Policy Learning
Authors: Alihan Hüyük, Daniel Jarrett, Cem Tekin, Mihaela van der Schaar
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Understanding human behavior from observed data is critical for transparency and accountability in decision-making. Consider real-world settings such as healthcare, in which modeling a decision-maker’s policy is challenging—with no access to underlying states, no knowledge of environment dynamics, and no allowance for live experimentation. We desire learning a data-driven representation of decision- making behavior that (1) inheres transparency by design, (2) accommodates partial observability, and (3) operates completely offline. To satisfy these key criteria, we propose a novel model-based Bayesian method for interpretable policy learning (“Interpole”) that jointly estimates an agent’s (possibly biased) belief-update process together with their (possibly suboptimal) belief-action mapping. Through experiments on both simulated and real-world data for the problem of Alzheimer’s disease diagnosis, we illustrate the potential of our approach as an investigative device for auditing, quantifying, and understanding human decision-making behavior.
BOIL: Towards Representation Change for Few-shot Learning
Authors: Jaehoon Oh, Hyungjun Yoo, ChangHwan Kim, Se-Young Yun
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Model Agnostic Meta-Learning (MAML) is one of the most representative of gradient-based meta-learning algorithms. MAML learns new tasks with a few data samples using inner updates from a meta-initialization point and learns the meta-initialization parameters with outer updates. It has recently been hypothesized that representation reuse, which makes little change in efficient representations, is the dominant factor in the performance of the meta-initialized model through MAML in contrast to representation change, which causes a significant change in representations. In this study, we investigate the necessity of representation change for the ultimate goal of few-shot learning, which is solving domain-agnostic tasks. To this aim, we propose a novel meta-learning algorithm, called BOIL (Body Only update in Inner Loop), which updates only the body (extractor) of the model and freezes the head (classifier) during inner loop updates. BOIL leverages representation change rather than representation reuse. A frozen head cannot achieve better results than even a random guessing classifier at the initial point of new tasks, and feature vectors (representations) have to move quickly to their corresponding frozen head vectors. We visualize this property using cosine similarity, CKA, and empirical results without the head. Although the inner loop updates purely hinge on representation change, BOIL empirically shows significant performance improvement over MAML, particularly on cross-domain tasks. The results imply that representation change in gradient-based meta-learning approaches is a critical component.
DeLighT: Deep and Light-weight Transformer
Authors: Sachin Mehta, Marjan Ghazvininejad, Srinivasan Iyer, Luke Zettlemoyer, Hannaneh Hajishirzi
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: We introduce a deep and light-weight transformer, DeLighT, that delivers similar or better performance than standard transformer-based models with significantly fewer parameters. DeLighT more efficiently allocates parameters both (1) within each Transformer block using the DeLighT transformation, a deep and light-weight transformation and (2) across blocks using block-wise scaling, that allows for shallower and narrower DeLighT blocks near the input and wider and deeper DeLighT blocks near the output. Overall, DeLighT networks are 2.5 to 4 times deeper than standard transformer models and yet have fewer parameters and operations. Experiments on benchmark machine translation and language modeling tasks show that DeLighT matches or improves the performance of baseline Transformers with 2 to 3 times fewer parameters on average.
Bayesian Context Aggregation for Neural Processes
Authors: Michael Volpp, Fabian Flürenbrock, Lukas Grossberger, Christian Daniel, Gerhard Neumann
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: Formulating scalable probabilistic regression models with reliable uncertainty estimates has been a long-standing challenge in machine learning research.  Recently, casting probabilistic regression as a multi-task learning problem in terms of conditional latent variable (CLV) models such as the Neural Process (NP) has shown promising results. In this paper, we focus on context aggregation, a central component of such architectures, which fuses information from multiple context data points. So far, this aggregation operation has been treated separately from the inference of a latent representation of the target function in CLV models. Our key contribution is to combine these steps into one holistic mechanism by phrasing context aggregation as a Bayesian inference problem. The resulting Bayesian Aggregation (BA) mechanism enables principled handling of task ambiguity, which is key for efficiently processing context information. We demonstrate on a range of challenging experiments that BA consistently improves upon the performance of traditional mean aggregation while remaining computationally efficient and fully compatible with existing NP-based models.
Tent: Fully Test-Time Adaptation by Entropy Minimization
Authors: Dequan Wang, Evan Shelhamer, Shaoteng Liu, Bruno Olshausen, Trevor Darrell
Published in: International Conference on Learning Representations 2021 (Main Conference Track), 2021

Abstract: A model must adapt itself to generalize to new and different data during testing. In this setting of fully test-time adaptation the model has only the test data and its own parameters. We propose to adapt by test entropy minimization (tent): we optimize the model for confidence as measured by the entropy of its predictions. Our method estimates normalization statistics and optimizes channel-wise affine transformations to update online on each batch. Tent reduces generalization error for image classification on corrupted ImageNet and CIFAR-10/100 and reaches a new state-of-the-art error on ImageNet-C. Tent handles source-free domain adaptation on digit recognition from SVHN to MNIST/MNIST-M/USPS, on semantic segmentation from GTA to Cityscapes, and on the VisDA-C benchmark. These results are achieved in one epoch of test-time optimization without altering training.