mtybilly/Instruct2DS huggingface dataset:
Learning Protein Structure with a Differentiable Simulator
Authors: John Ingraham, Adam Riesselman, Chris Sander, Debora Marks
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: The Boltzmann distribution is a natural model for many systems, from brains to materials and biomolecules, but is often of limited utility for fitting data because Monte Carlo algorithms are unable to simulate it in available time. This gap between the expressive capabilities and sampling practicalities of energy-based models is exemplified by the protein folding problem, since energy landscapes underlie contemporary knowledge of protein biophysics but computer simulations are challenged to fold all but the smallest proteins from first principles. In this work we aim to bridge the gap between the expressive capacity of energy functions and the practical capabilities of their simulators by using an unrolled Monte Carlo simulation as a model for data. We compose a neural energy function with a novel and efficient simulator based on Langevin dynamics to build an end-to-end-differentiable model of atomic protein structure given amino acid sequence information. We introduce techniques for stabilizing backpropagation under long roll-outs and demonstrate the model's capacity to make multimodal predictions and to, in some cases, generalize to unobserved protein fold types when trained on a large corpus of protein structures.
Robust Conditional Generative Adversarial Networks
Authors: Grigorios G. Chrysos, Jean Kossaifi, Stefanos Zafeiriou
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Conditional generative adversarial networks (cGAN) have led to large improvements in the task of conditional image generation, which lies at the heart of computer vision. The major focus so far has been on performance improvement, while there has been little effort in making cGAN more robust to noise. The regression (of the generator) might lead to arbitrarily large errors in the output, which makes cGAN unreliable for real-world applications. In this work, we introduce a novel conditional GAN model, called RoCGAN, which leverages structure in the target space of the model to address the issue. Our model augments the generator with an unsupervised pathway, which promotes the outputs of the generator to span the target manifold even in the presence of intense noise. We prove that RoCGAN share similar theoretical properties as GAN and experimentally verify that our model outperforms existing state-of-the-art cGAN architectures by a large margin in a variety of domains including images from natural scenes and faces.
Learning to Design RNA
Authors: Frederic Runge, Danny Stoll, Stefan Falkner, Frank Hutter
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Designing RNA molecules has garnered recent interest in medicine, synthetic biology, biotechnology and bioinformatics since many functional RNA molecules were shown to be involved in regulatory processes for transcription, epigenetics and translation. Since an RNA's function depends on its structural properties, the RNA Design problem is to find an RNA sequence which satisfies given structural constraints. Here, we propose a new algorithm for the RNA Design problem, dubbed LEARNA. LEARNA uses deep reinforcement learning to train a policy network to sequentially design an entire RNA sequence given a specified target structure. By meta-learning across 65000 different RNA Design tasks for one hour on 20 CPU cores, our extension Meta-LEARNA constructs an RNA Design policy that can be applied out of the box to solve novel RNA Design tasks. Methodologically, for what we believe to be the first time, we jointly optimize over a rich space of architectures for the policy network, the hyperparameters of the training procedure and the formulation of the decision process. Comprehensive empirical results on two widely-used RNA Design benchmarks, as well as a third one that we introduce, show that our approach achieves new state-of-the-art performance on the former while also being orders of magnitudes faster in reaching the previous state-of-the-art performance. In an ablation study, we analyze the importance of our method's different components.
FlowQA: Grasping Flow in History for Conversational Machine Comprehension
Authors: Hsin-Yuan Huang, Eunsol Choi, Wen-tau Yih
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Conversational machine comprehension requires a deep understanding of the conversation history. To enable traditional, single-turn models to encode the history comprehensively, we introduce Flow, a mechanism that can incorporate intermediate representations generated during the process of answering previous questions, through an alternating parallel processing structure. Compared to shallow approaches that concatenate previous questions/answers as input, Flow integrates the latent semantics of the conversation history more deeply. Our model, FlowQA, shows superior performance on two recently proposed conversational challenges (+7.2% F1 on CoQA and +4.0% on QuAC). The effectiveness of Flow also shows in other tasks. By reducing sequential instruction understanding to conversational machine comprehension, FlowQA outperforms the best models on all three domains in SCONE, with +1.8% to +4.4% improvement in accuracy.
DHER: Hindsight Experience Replay for Dynamic Goals
Authors: Meng Fang, Cheng Zhou, Bei Shi, Boqing Gong, Jia Xu, Tong Zhang
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Dealing with sparse rewards is one of the most important challenges in reinforcement learning (RL), especially when a goal is dynamic (e.g., to grasp a moving object). Hindsight experience replay (HER) has been shown an effective solution to handling  sparse rewards with fixed goals. However, it does not account for dynamic goals in its vanilla form and, as a result, even degrades the performance of existing off-policy RL algorithms when the goal is changing over time. 

In this paper, we present  Dynamic Hindsight Experience Replay (DHER), a novel approach for tasks with dynamic goals in the presence of sparse rewards. DHER automatically assembles successful experiences from two relevant failures and can be used to enhance an arbitrary off-policy RL algorithm when the tasks' goals are dynamic. We evaluate DHER on tasks of robotic manipulation and moving object tracking, and transfer the polices from simulation to physical robots. Extensive comparison and ablation studies demonstrate  the superiority of our approach, showing that DHER is a crucial ingredient to enable RL to solve tasks with dynamic goals in manipulation and grid world domains.
Plan Online, Learn Offline: Efficient Learning and Exploration via Model-Based Control
Authors: Kendall Lowrey, Aravind Rajeswaran, Sham Kakade, Emanuel Todorov, Igor Mordatch
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: We propose a "plan online and learn offline" framework for the setting where an agent, with an internal model, needs to continually act and learn in the world. Our work builds on the synergistic relationship between local model-based control, global value function learning, and exploration. We study how local trajectory optimization can cope with approximation errors  in the value function, and can stabilize and accelerate value function learning. Conversely, we also study how approximate value functions can help reduce the planning horizon and allow for better policies beyond local solutions. Finally, we also demonstrate how trajectory optimization can be used to perform temporally coordinated exploration in conjunction with estimating uncertainty in value function approximation. This exploration is critical for fast and stable learning of the value function. Combining these components enable solutions to complex control tasks, like humanoid locomotion and dexterous in-hand manipulation, in the equivalent of a few minutes of experience in the real world.
Probabilistic Planning with Sequential Monte Carlo methods
Authors: Alexandre Piche, Valentin Thomas, Cyril Ibrahim, Yoshua Bengio, Chris Pal
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: In this work, we propose a novel formulation of planning which views it as a probabilistic inference problem over future optimal trajectories. This enables us to use sampling methods, and thus, tackle planning in continuous domains using a fixed computational budget.   We design a new algorithm,  Sequential Monte Carlo Planning, by leveraging classical methods in Sequential Monte Carlo and Bayesian smoothing in the context of control as inference. Furthermore, we show that Sequential Monte Carlo Planning can capture multimodal policies and can quickly learn continuous control tasks.
KnockoffGAN: Generating Knockoffs for Feature Selection using Generative Adversarial Networks
Authors: James Jordon, Jinsung Yoon, Mihaela van der Schaar
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Feature selection is a pervasive problem. The discovery of relevant features can be as important for performing a particular task (such as to avoid overfitting in prediction) as it can be for understanding the underlying processes governing the true label (such as discovering relevant genetic factors for a disease). Machine learning driven feature selection can enable discovery from large, high-dimensional, non-linear observational datasets by creating a subset of features for experts to focus on. In order to use expert time most efficiently, we need a principled methodology capable of controlling the False Discovery Rate. In this work, we build on the promising Knockoff framework by developing a flexible knockoff generation model. We adapt the Generative Adversarial Networks framework to allow us to generate knockoffs with no assumptions on the feature distribution. Our model consists of 4 networks, a generator, a discriminator, a stability network and a power network. We demonstrate the capability of our model to perform feature selection, showing that it performs as well as the originally proposed knockoff generation model in the Gaussian setting and that it outperforms the original model in non-Gaussian settings, including on a real-world dataset.
Adaptive Posterior Learning: few-shot learning with a surprise-based memory module
Authors: Tiago Ramalho, Marta Garnelo
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: The ability to generalize quickly from few observations is crucial for intelligent systems. In this paper we introduce APL, an algorithm that approximates probability distributions by remembering the most surprising observations it has encountered. These past observations are recalled from an external memory module and processed by a decoder network that can combine information from different memory slots to generalize beyond direct recall. We show this algorithm can perform as well as state of the art baselines on few-shot classification benchmarks with a smaller memory footprint.  In addition, its memory compression allows it to scale to thousands of unknown labels.  Finally, we introduce a meta-learning reasoning task which is more challenging than direct classification. In this setting, APL is able to generalize with fewer than one example per class via deductive reasoning.
Learning to Screen for Fast Softmax  Inference on Large Vocabulary Neural Networks
Authors: Patrick Chen, Si Si, Sanjiv Kumar, Yang Li, Cho-Jui Hsieh
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Neural language models have been widely used in various NLP tasks, including machine translation, next word prediction and conversational agents. However, it is challenging to deploy these models on mobile devices due to their slow prediction speed, where the bottleneck is to compute top candidates in the softmax layer. In this paper, we introduce a novel softmax layer approximation algorithm by exploiting the clustering structure of context vectors. Our algorithm uses a light-weight screening model to predict a much smaller set of candidate words based on the given context, and then conducts an exact softmax only within that subset. Training such a procedure end-to-end is challenging as traditional clustering methods are discrete and non-differentiable, and thus unable to be used with back-propagation in the training process. Using the Gumbel softmax, we are able to train the screening model end-to-end on the training set to exploit data distribution. The algorithm achieves an order of magnitude faster inference than the original softmax layer for predicting top-k words in various tasks such as beam search in machine translation or next words prediction. For example, for machine translation task on German to English dataset with around 25K vocabulary, we can achieve 20.4 times speed up with 98.9% precision@1 and 99.3% precision@5 with the original softmax layer prediction, while state-of-the-art (Zhang et al., 2018) only achieves 6.7x speedup with 98.7% precision@1 and 98.1% precision@5 for the same task.
Adversarial Audio Synthesis
Authors: Chris Donahue, Julian McAuley, Miller Puckette
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Audio signals are sampled at high temporal resolutions, and learning to synthesize audio requires capturing structure across a range of timescales. Generative adversarial networks (GANs) have seen wide success at generating images that are both locally and globally coherent, but they have seen little application to audio generation. In this paper we introduce WaveGAN, a first attempt at applying GANs to unsupervised synthesis of raw-waveform audio. WaveGAN is capable of synthesizing one second slices of audio waveforms with global coherence, suitable for sound effect generation. Our experiments demonstrate that—without labels—WaveGAN learns to produce intelligible words when trained on a small-vocabulary speech dataset, and can also synthesize audio from other domains such as drums, bird vocalizations, and piano. We compare WaveGAN to a method which applies GANs designed for image generation on image-like audio feature representations, finding both approaches to be promising.
Quaternion Recurrent Neural Networks
Authors: Titouan Parcollet, Mirco Ravanelli, Mohamed Morchid, Georges Linarès, Chiheb Trabelsi, Renato De Mori, Yoshua Bengio
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Recurrent neural networks (RNNs) are powerful architectures to model sequential data, due to their capability to learn short and long-term dependencies between the basic elements of a sequence. Nonetheless, popular tasks such as speech or images recognition, involve multi-dimensional input features that are characterized by strong internal dependencies between the dimensions of the input vector. We propose a novel quaternion recurrent neural network (QRNN), alongside with a quaternion long-short term memory neural network (QLSTM), that take into account both the external relations and these internal structural dependencies with the quaternion algebra. Similarly to capsules, quaternions allow the QRNN to code internal dependencies by composing and processing multidimensional features as single entities, while the recurrent operation reveals correlations between the elements composing the sequence. We show that both QRNN and QLSTM achieve better performances than RNN and LSTM in a realistic application of automatic speech recognition. Finally, we show that QRNN and QLSTM reduce by a maximum factor of 3.3x the number of free parameters needed, compared to real-valued RNNs and LSTMs to reach better results, leading to a more compact representation of the relevant information.
Efficient Multi-Objective Neural Architecture Search via Lamarckian Evolution
Authors: Thomas Elsken, Jan Hendrik Metzen, Frank Hutter
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Architecture search aims at automatically finding neural architectures that are competitive with architectures designed by human experts. While recent approaches have achieved state-of-the-art predictive performance for image recognition, they are problematic under resource constraints for two reasons: (1) the neural architectures found are solely optimized for high predictive performance, without penalizing excessive resource consumption; (2)most architecture search methods require vast computational resources. We address the first shortcoming by proposing LEMONADE, an evolutionary algorithm for multi-objective architecture search that allows approximating the Pareto-front of architectures under multiple objectives, such as predictive performance and number of parameters, in a single run of the method. We address the second shortcoming by proposing a Lamarckian inheritance mechanism for LEMONADE which generates children networks that are warmstarted with the predictive performance of their trained parents. This is accomplished by using (approximate) network morphism operators for generating children. The combination of these two contributions allows finding models that are on par or even outperform different-sized NASNets, MobileNets, MobileNets V2 and Wide Residual Networks on CIFAR-10 and ImageNet64x64 within only one week on eight GPUs, which is about 20-40x less compute power than previous architecture search methods that yield state-of-the-art performance.
The Deep Weight Prior
Authors: Andrei Atanov, Arsenii Ashukha, Kirill Struminsky, Dmitriy Vetrov, Max Welling
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Bayesian inference is known to provide a general framework for incorporating prior knowledge or specific properties into machine learning models via carefully choosing a prior distribution. In this work, we propose a new type of prior distributions for convolutional neural networks, deep weight prior (DWP), that exploit generative models to encourage a specific structure of trained convolutional filters e.g., spatial correlations of weights. We define DWP in the form of an implicit distribution and propose a method for variational inference with such type of implicit priors. In experiments, we show that DWP improves the performance of Bayesian neural networks when training data are limited, and initialization of weights with samples from DWP accelerates training of conventional convolutional neural networks.
M^3RL: Mind-aware Multi-agent Management Reinforcement Learning
Authors: Tianmin Shu, Yuandong Tian
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Most of the prior work on multi-agent reinforcement learning (MARL) achieves optimal collaboration by directly learning a policy for each agent to maximize a common reward. In this paper, we aim to address this from a different angle. In particular, we consider scenarios where there are self-interested agents (i.e., worker agents) which have their own minds (preferences, intentions, skills, etc.) and can not be dictated to perform tasks they do not want to do. For achieving optimal coordination among these agents, we train a super agent (i.e., the manager) to manage them by first inferring their minds based on both current and past observations and then initiating contracts to assign suitable tasks to workers and promise to reward them with corresponding bonuses so that they will agree to work together. The objective of the manager is to maximize the overall productivity as well as minimize payments made to the workers for ad-hoc worker teaming. To train the manager, we propose Mind-aware Multi-agent Management Reinforcement Learning (M^3RL), which consists of agent modeling and policy learning. We have evaluated our approach in two environments, Resource Collection and Crafting, to simulate multi-agent management problems with various task settings and multiple designs for the worker agents. The experimental results have validated the effectiveness of our approach in modeling worker agents' minds online, and in achieving optimal ad-hoc teaming with good generalization and fast adaptation.
Selfless Sequential Learning
Authors: Rahaf Aljundi, Marcus Rohrbach, Tinne Tuytelaars
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Sequential learning, also called lifelong learning, studies the problem of learning tasks in a sequence with access restricted to only the data of the current task. In this paper we look at a scenario with fixed model capacity, and postulate that the learning process should not be selfish, i.e. it should account for future tasks to be added and thus leave enough capacity for them. To achieve Selfless Sequential Learning we study different regularization strategies and activation functions. We find that
imposing sparsity at the level of the representation (i.e. neuron activations) is more beneficial for sequential learning than encouraging parameter sparsity. In particular, we propose a novel regularizer, that encourages representation sparsity by means of neural inhibition. It results in few active neurons which in turn leaves more free neurons to be utilized by upcoming tasks. As neural inhibition over an entire layer can be too drastic, especially for complex tasks requiring strong representations,
our regularizer only inhibits other neurons in a local neighbourhood, inspired by lateral inhibition processes in the brain. We combine our novel regularizer with state-of-the-art lifelong learning methods that penalize changes to important previously learned parts of the network. We show that our new regularizer leads to increased sparsity which translates in consistent performance improvement on diverse datasets.
Diversity and Depth in Per-Example Routing Models
Authors: Prajit Ramachandran, Quoc V. Le
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Routing models, a form of conditional computation where examples are routed through a subset of components in a larger network, have shown promising results in recent works. Surprisingly, routing models to date have lacked important properties, such as architectural diversity and large numbers of routing decisions. Both architectural diversity and routing depth can increase the representational power of a routing network. In this work, we address both of these deficiencies. We discuss the significance of architectural diversity in routing models, and explain the tradeoffs between capacity and optimization when increasing routing depth. In our experiments, we find that adding architectural diversity to routing models significantly improves performance, cutting the error rates of a strong baseline by 35% on an Omniglot setup. However, when scaling up routing depth, we find that modern routing techniques struggle with optimization. We conclude by discussing both the positive and negative results, and suggest directions for future research.
Generative Question Answering: Learning to Answer the Whole Question
Authors: Mike Lewis, Angela Fan
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Discriminative  question  answering  models  can  overfit  to  superficial  biases  in datasets,  because their loss function saturates when any clue makes the answer likely.  We introduce generative models of the joint distribution of questions and answers, which are trained to explain the whole question, not just to answer it.Our  question  answering  (QA)  model  is  implemented  by  learning  a  prior  over answers,  and  a  conditional  language  model  to  generate  the  question  given  the answer—allowing scalable and interpretable many-hop reasoning as the question is generated word-by-word.  Our model achieves competitive performance with specialised discriminative models on the SQUAD and CLEVR benchmarks, indicating that it is a more general architecture for language understanding and reasoning than previous work. The model greatly improves generalisation both from biased training data and to adversarial testing data, achieving a new state-of-the-art on ADVERSARIAL SQUAD. We will release our code.
Posterior Attention Models for Sequence to Sequence Learning
Authors: Shiv Shankar, Sunita Sarawagi
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Modern neural architectures critically rely on attention for mapping structured inputs to sequences. In this paper we show that prevalent attention architectures do not adequately model the dependence among the attention and output tokens across a predicted sequence.
We present an alternative architecture called  Posterior Attention Models that after a principled factorization of the full joint distribution of the attention and output variables, proposes two major changes.  First, the position where attention is marginalized is changed from the input to the output. Second, the attention propagated to the next decoding stage is a posterior attention distribution conditioned on the output. Empirically on five translation and two morphological inflection tasks the proposed posterior attention models yield better BLEU score and alignment accuracy than existing attention models.
Learning deep representations by mutual information estimation and maximization
Authors: R Devon Hjelm, Alex Fedorov, Samuel Lavoie-Marchildon, Karan Grewal, Phil Bachman, Adam Trischler, Yoshua Bengio
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: This work investigates unsupervised learning of representations by maximizing mutual information between an input and the output of a deep neural network encoder. Importantly, we show that structure matters: incorporating knowledge about locality in the input into the objective can significantly improve a representation's suitability for downstream tasks. We further control characteristics of the representation by matching to a prior distribution adversarially. Our method, which we call Deep InfoMax (DIM), outperforms a number of popular unsupervised learning methods and compares favorably with fully-supervised learning on several classification tasks in with some standard architectures. DIM opens new avenues for unsupervised learning of representations and is an important step towards flexible formulations of representation learning objectives for specific end-goals.
A comprehensive, application-oriented study of catastrophic forgetting in DNNs
Authors: B. Pfülb, A. Gepperth
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: We present a large-scale empirical study of catastrophic forgetting (CF) in modern Deep Neural Network (DNN) models that perform sequential (or: incremental) learning.
A new experimental protocol is proposed that takes into account typical constraints encountered in application scenarios.
As the investigation is empirical, we evaluate CF behavior on the hitherto largest number of visual classification datasets, from each of which we construct a representative number of Sequential Learning Tasks (SLTs) in close alignment to previous works on CF.
Our results clearly indicate that there is no model that avoids CF for all investigated datasets and SLTs under application conditions. We conclude with a discussion of potential solutions and workarounds to CF, notably for the EWC and IMM models.
Unsupervised Domain Adaptation for Distance Metric Learning
Authors: Kihyuk Sohn, Wenling Shang, Xiang Yu, Manmohan Chandraker
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Unsupervised domain adaptation is a promising avenue to enhance the performance of deep neural networks on a target domain, using labels only from a source domain. However, the two predominant methods, domain discrepancy reduction learning and semi-supervised learning, are not readily applicable when source and target domains do not share a common label space. This paper addresses the above scenario by learning a representation space that retains discriminative power on both the (labeled) source and (unlabeled) target domains while keeping representations for the two domains well-separated. Inspired by a theoretical analysis, we first reformulate the disjoint classification task, where the source and target domains correspond to non-overlapping class labels, to a verification one. To handle both within and cross domain verifications, we propose a Feature Transfer Network (FTN) to separate the target feature space from the original source space while aligned with a transformed source space. Moreover, we present a non-parametric multi-class entropy minimization loss to further boost the discriminative power of FTNs on the target domain. In experiments, we first illustrate how FTN works in a controlled setting of adapting from MNIST-M to MNIST with disjoint digit classes between the two domains and then demonstrate the effectiveness of FTNs through state-of-the-art performances on a cross-ethnicity face recognition problem.
Deep Convolutional Networks as shallow Gaussian Processes
Authors: Adrià Garriga-Alonso, Carl Edward Rasmussen, Laurence Aitchison
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: We show that the output of a (residual) CNN with an appropriate prior over the weights and biases is a GP in the limit of infinitely many convolutional filters, extending similar results for dense networks. For a CNN, the equivalent kernel can be computed exactly and, unlike "deep kernels", has very few parameters: only the hyperparameters of the original CNN. Further, we show that this kernel has two properties that allow it to be computed efficiently; the cost of evaluating the kernel for a pair of images is similar to a single forward pass through the original CNN with only one filter per layer. The kernel equivalent to a 32-layer ResNet obtains 0.84% classification error on MNIST, a new record for GP with a comparable number of parameters.
Accumulation Bit-Width Scaling For Ultra-Low Precision Training Of Deep Networks
Authors: Charbel Sakr, Naigang Wang, Chia-Yu Chen, Jungwook Choi, Ankur Agrawal, Naresh Shanbhag, Kailash Gopalakrishnan
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Efforts to reduce the numerical precision of computations in deep learning training have yielded systems that aggressively quantize weights and activations, yet employ wide high-precision accumulators for partial sums in inner-product operations to preserve the quality of convergence. The absence of any framework to analyze the precision requirements of partial sum accumulations results in conservative design choices. This imposes an upper-bound on the reduction of complexity of multiply-accumulate units. We present a statistical approach to analyze the impact of reduced accumulation precision on deep learning training. Observing that a bad choice for accumulation precision results in loss of information that manifests itself as a reduction in variance in an ensemble of partial sums, we derive a set of equations that relate this variance to the length of accumulation and the minimum number of bits needed for accumulation. We apply our analysis to three benchmark networks: CIFAR-10 ResNet 32, ImageNet ResNet 18 and ImageNet AlexNet. In each case, with accumulation precision set in accordance with our proposed equations, the networks successfully converge to the single precision floating-point baseline. We also show that reducing accumulation precision further degrades the quality of the trained network, proving that our equations produce tight bounds. Overall this analysis enables precise tailoring of computation hardware to the application, yielding area- and power-optimal systems.
Deep Lagrangian Networks: Using Physics as Model Prior for Deep Learning
Authors: Michael Lutter, Christian Ritter, Jan Peters
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Deep learning has achieved astonishing results on many tasks with large amounts of data and generalization within the proximity of training data. For many important real-world applications, these requirements are unfeasible and additional prior knowledge on the task domain is required to overcome the resulting problems. In particular, learning physics models for model-based control requires robust extrapolation from fewer samples – often collected online in real-time – and model errors may lead to drastic damages of the system.
Directly incorporating physical insight has enabled us to obtain a novel deep model learning approach that extrapolates well while requiring fewer samples. As a first example, we propose Deep Lagrangian Networks (DeLaN) as a deep network structure upon which Lagrangian Mechanics have been imposed. DeLaN can learn the equations of motion of a mechanical system (i.e., system dynamics) with a deep network efficiently while ensuring physical plausibility.
The resulting DeLaN network performs very well at robot tracking control. The proposed method did not only outperform previous model learning approaches at learning speed but exhibits substantially improved and more robust extrapolation to novel trajectories and learns online in real-time.
Optimal Transport Maps For Distribution Preserving Operations on Latent Spaces of Generative Models
Authors: Eirikur Agustsson, Alexander Sage, Radu Timofte, Luc Van Gool
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Generative models such as Variational Auto Encoders (VAEs) and Generative Adversarial Networks (GANs) are typically trained for a fixed prior distribution in the latent space, such as uniform or Gaussian. After a trained model is obtained, one can sample the Generator in various forms for exploration and understanding, such as interpolating between two samples, sampling in the vicinity of a sample or exploring differences between a pair of samples applied to a third sample. However, the latent space operations commonly used in the literature so far induce a distribution mismatch between the resulting outputs and the prior distribution the model was trained on. Previous works have attempted to reduce this mismatch with heuristic modification to the operations or by changing the latent distribution and re-training models. In this paper, we propose a framework for modifying the latent space operations such that the distribution mismatch is fully eliminated. Our approach is based on optimal transport maps, which adapt the latent space operations such that they fully match the prior distribution, while minimally modifying the original operation. Our matched operations are readily obtained for the commonly used operations and distributions and require no adjustment to the training procedure.
Spherical CNNs on Unstructured Grids
Authors: Chiyu Max Jiang, Jingwei Huang, Karthik Kashinath, Prabhat, Philip Marcus, Matthias Niessner
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: We present an efficient convolution kernel for Convolutional Neural Networks (CNNs) on unstructured grids using parameterized differential operators while focusing on spherical signals such as panorama images or planetary signals. 
To this end, we replace conventional convolution kernels with linear combinations of differential operators that are weighted by learnable parameters. Differential operators can be efficiently estimated on unstructured grids using one-ring neighbors, and learnable parameters can be optimized through standard back-propagation. As a result, we obtain extremely efficient neural networks that match or outperform state-of-the-art network architectures in terms of performance but with a significantly lower number of network parameters. We evaluate our algorithm in an extensive series of experiments on a variety of computer vision and climate science tasks, including shape classification, climate pattern segmentation, and omnidirectional image semantic segmentation. Overall, we present (1) a novel CNN approach on unstructured grids using parameterized differential operators for spherical signals, and (2) we show that our unique kernel parameterization allows our model to achieve the same or higher accuracy with significantly fewer network parameters.
Structured Adversarial Attack:  Towards General Implementation and Better Interpretability
Authors: Kaidi Xu, Sijia Liu, Pu Zhao, Pin-Yu Chen, Huan Zhang, Quanfu Fan, Deniz Erdogmus, Yanzhi Wang, Xue Lin
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: When generating adversarial examples to attack deep neural networks (DNNs), Lp norm of the added perturbation is usually used to measure the similarity between original image and adversarial example. However, such adversarial attacks perturbing the raw input spaces may fail to capture structural information hidden in the input.   This work develops a more general attack model,  i.e., the structured attack (StrAttack),  which explores group sparsity in adversarial perturbation by sliding a mask through images aiming for extracting key spatial structures.  An ADMM (alternating direction method of multipliers)-based framework is proposed that can split the original problem into a sequence of analytically solvable subproblems and can be generalized to implement other attacking methods. Strong group sparsity is achieved in adversarial perturbations even with the same level of Lp-norm distortion (p∈ {1,2,∞}) as the state-of-the-art attacks. We demonstrate the effectiveness of StrAttack by extensive experimental results on MNIST, CIFAR-10 and ImageNet. We also show that StrAttack provides better interpretability (i.e., better correspondence with discriminative image regions) through adversarial saliency map (Paper-not et al., 2016b) and class activation map (Zhou et al., 2016).
Function Space Particle Optimization for Bayesian Neural Networks
Authors: Ziyu Wang, Tongzheng Ren, Jun Zhu, Bo Zhang
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: While Bayesian neural networks (BNNs) have drawn increasing attention, their posterior inference remains challenging, due to the high-dimensional and over-parameterized nature. To address this issue, several highly flexible and scalable variational inference procedures based on the idea of particle optimization have been proposed. These methods directly optimize a set of particles to approximate the target posterior. However, their application to BNNs often yields sub-optimal performance, as such methods have a particular failure mode on over-parameterized models. In this paper, we propose to solve this issue by performing particle optimization directly in the space of regression functions. We demonstrate through extensive experiments that our method successfully overcomes this issue, and outperforms strong baselines in a variety of tasks including prediction, defense against adversarial examples, and reinforcement learning.
Neural Graph Evolution: Towards Efficient Automatic Robot Design
Authors: Tingwu Wang, Yuhao Zhou, Sanja Fidler, Jimmy Ba
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Despite the recent successes in robotic locomotion control, the design of robot relies heavily on human engineering. Automatic robot design has been a long studied subject, but the recent progress has been slowed due to the large combinatorial search space and the difficulty in evaluating the found candidates. To address the two challenges, we formulate automatic robot design as a graph search problem and perform evolution search in graph space. We propose Neural Graph Evolution (NGE), which performs selection on current candidates and evolves new ones iteratively. Different from previous approaches, NGE uses graph neural networks to parameterize the control policies, which reduces evaluation cost on new candidates with the help of skill transfer from previously evaluated designs. In addition, NGE applies Graph Mutation with Uncertainty (GM-UC) by incorporating model uncertainty, which reduces the search space by balancing exploration and exploitation. We show that NGE significantly outperforms previous methods by an order of magnitude. As shown in experiments, NGE is the first algorithm that can automatically discover kinematically preferred robotic graph structures, such as a fish with two symmetrical flat side-fins and a tail, or a cheetah with athletic front and back legs. Instead of using thousands of cores for weeks, NGE efficiently solves searching problem within a day on a single 64 CPU-core Amazon EC2
machine.
No Training Required: Exploring Random Encoders for Sentence Classification
Authors: John Wieting, Douwe Kiela
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: We explore various methods for computing sentence representations from pre-trained word embeddings without any training, i.e., using nothing but random parameterizations. Our aim is to put sentence embeddings on more solid footing by 1) looking at how much modern sentence embeddings gain over random methods---as it turns out, surprisingly little; and by 2) providing the field with more appropriate baselines going forward---which are, as it turns out, quite strong. We also make important observations about proper experimental protocol for sentence classification evaluation, together with recommendations for future research.
DialogWAE: Multimodal Response Generation with Conditional Wasserstein Auto-Encoder
Authors: Xiaodong Gu, Kyunghyun Cho, Jung-Woo Ha, Sunghun Kim
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Variational autoencoders (VAEs) have shown a promise in data-driven conversation modeling. However, most VAE conversation models match the approximate posterior distribution over the latent variables to a simple prior such as standard normal distribution, thereby restricting the generated responses to a relatively simple (e.g., single-modal) scope. In this paper, we propose DialogWAE, a conditional Wasserstein autoencoder (WAE) specially designed for dialogue modeling. Unlike VAEs that impose a simple distribution over the latent variables, DialogWAE models the distribution of data by training a GAN within the latent variable space. Specifically, our model samples from the prior and posterior distributions over the latent variables by transforming context-dependent random noise using neural networks and minimizes the Wasserstein distance between the two distributions. We further develop a Gaussian mixture prior network to enrich the latent space. Experiments on two popular datasets show that DialogWAE outperforms the state-of-the-art approaches in generating more coherent, informative and diverse responses.
Optimistic mirror descent in saddle-point problems: Going the extra (gradient) mile
Authors: Panayotis Mertikopoulos, Bruno Lecouat, Houssam Zenati, Chuan-Sheng Foo, Vijay Chandrasekhar, Georgios Piliouras
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Owing to their connection with generative adversarial networks (GANs), saddle-point problems have recently attracted considerable interest in machine learning and beyond. By necessity, most theoretical guarantees revolve around convex-concave (or even linear) problems; however, making theoretical inroads towards efficient GAN training depends crucially on moving beyond this classic framework. To make piecemeal progress along these lines, we analyze the behavior of mirror descent (MD) in a class of non-monotone problems whose solutions coincide with those of a naturally associated variational inequality – a property which we call coherence. We first show that ordinary, “vanilla” MD converges under a strict version of this condition, but not otherwise; in particular, it may fail to converge even in bilinear models with a unique solution. We then show that this deficiency is mitigated by optimism: by taking an “extra-gradient” step, optimistic mirror descent (OMD) converges in all coherent problems. Our analysis generalizes and extends the results of Daskalakis et al. [2018] for optimistic gradient descent (OGD) in bilinear problems, and makes concrete headway for provable convergence beyond convex-concave games. We also provide stochastic analogues of these results, and we validate our analysis by numerical experiments in a wide array of GAN models (including Gaussian mixture models, and the CelebA and CIFAR-10 datasets).
Decoupled Weight Decay Regularization
Authors: Ilya Loshchilov, Frank Hutter
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: L$_2$ regularization and weight decay regularization are equivalent for standard stochastic gradient descent (when rescaled by the learning rate), but as we demonstrate this is \emph{not} the case for adaptive gradient algorithms, such as Adam. While common implementations of these algorithms employ L$_2$ regularization (often calling it ``weight decay'' in what may be misleading due to the inequivalence we expose), we propose a simple modification to recover the original formulation of weight decay regularization by \emph{decoupling} the weight decay from the optimization steps taken w.r.t. the loss function. We provide empirical evidence that our proposed modification (i) decouples the optimal choice of weight decay factor from the setting of the learning rate for both standard SGD and Adam and (ii) substantially improves Adam's generalization performance, allowing it to compete with SGD with momentum on image classification datasets (on which it was previously typically outperformed by the latter). Our proposed decoupled weight decay has already been adopted by many researchers, and the community has implemented it in TensorFlow and PyTorch; the complete source code for our experiments is available at \url{https://github.com/loshchil/AdamW-and-SGDW}
Adaptive Gradient Methods with Dynamic Bound of Learning Rate
Authors: Liangchen Luo, Yuanhao Xiong, Yan Liu, Xu Sun
Published in: International Conference on Learning Representations 2019 (Main Conference Track), 2019

Abstract: Adaptive optimization methods such as AdaGrad, RMSprop and Adam have been proposed to achieve a rapid training process with an element-wise scaling term on learning rates. Though prevailing, they are observed to generalize poorly compared with SGD or even fail to converge due to unstable and extreme learning rates. Recent work has put forward some algorithms such as AMSGrad to tackle this issue but they failed to achieve considerable improvement over existing methods. In our paper, we demonstrate that extreme learning rates can lead to poor performance. We provide new variants of Adam and AMSGrad, called AdaBound and AMSBound respectively, which employ dynamic bounds on learning rates to achieve a gradual and smooth transition from adaptive methods to SGD and give a theoretical proof of convergence. We further conduct experiments on various popular tasks and models, which is often insufficient in previous work. Experimental results show that new variants can eliminate the generalization gap between adaptive methods and SGD and maintain higher learning speed early in training at the same time. Moreover, they can bring significant improvement over their prototypes, especially on complex deep networks. The implementation of the algorithm can be found at https://github.com/Luolc/AdaBound .