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Tomoharu Iwata

Publications and source records attributed to Tomoharu Iwata.

At least 73 records · Page 4Linked to original sources
arXiv2020

Probabilistic Optimal Transport based on Collective Graphical Models

Optimal Transport (OT) is being widely used in various fields such as machine learning and computer vision, as it is a powerful tool for measuring the similarity between probability distributions and histograms. In previous studies, OT has been defined as the minimum cost to transport probability mass from one probability distribution to another. In this study, we propose a new framework in which OT is considered as a maximum a posteriori (MAP) solution of a probabilistic generative model. With the proposed framework, we show that OT with entropic regularization is equivalent to maximizing a posterior probability of a probabilistic model called Collective Graphical Model (CGM), which describes aggregated statistics of multiple samples generated from a graphical model. Interpreting OT as a MAP solution of a CGM has the following two advantages: (i) We can calculate the discrepancy between noisy histograms by modeling noise distributions. Since various distributions can be used for noise modeling, it is possible to select the noise distribution flexibly to suit the situation. (ii) We can construct a new method for interpolation between histograms, which is an important application of OT. The proposed method allows for intuitive modeling based on the probabilistic interpretations, and a simple and efficient estimation algorithm is available. Experiments using synthetic and real-world spatio-temporal population datasets show the effectiveness of the proposed interpolation method.

stat.ML↗
arXiv2020

Neural Generators of Sparse Local Linear Models for Achieving both Accuracy and Interpretability

For reliability, it is important that the predictions made by machine learning methods are interpretable by human. In general, deep neural networks (DNNs) can provide accurate predictions, although it is difficult to interpret why such predictions are obtained by DNNs. On the other hand, interpretation of linear models is easy, although their predictive performance would be low since real-world data is often intrinsically non-linear. To combine both the benefits of the high predictive performance of DNNs and high interpretability of linear models into a single model, we propose neural generators of sparse local linear models (NGSLLs). The sparse local linear models have high flexibility as they can approximate non-linear functions. The NGSLL generates sparse linear weights for each sample using DNNs that take original representations of each sample (e.g., word sequence) and their simplified representations (e.g., bag-of-words) as input. By extracting features from the original representations, the weights can contain rich information to achieve high predictive performance. Additionally, the prediction is interpretable because it is obtained by the inner product between the simplified representations and the sparse weights, where only a small number of weights are selected by our gate module in the NGSLL. In experiments with real-world datasets, we demonstrate the effectiveness of the NGSLL quantitatively and qualitatively by evaluating prediction performance and visualizing generated weights on image and text classification tasks.

cs.LG↗
arXiv2020

Semi-supervised Anomaly Detection on Attributed Graphs

We propose a simple yet effective method for detecting anomalous instances on an attribute graph with label information of a small number of instances. Although with standard anomaly detection methods it is usually assumed that instances are independent and identically distributed, in many real-world applications, instances are often explicitly connected with each other, resulting in so-called attributed graphs. The proposed method embeds nodes (instances) on the attributed graph in the latent space by taking into account their attributes as well as the graph structure based on graph convolutional networks (GCNs). To learn node embeddings specialized for anomaly detection, in which there is a class imbalance due to the rarity of anomalies, the parameters of a GCN are trained to minimize the volume of a hypersphere that encloses the node embeddings of normal instances while embedding anomalous ones outside the hypersphere. This enables us to detect anomalies by simply calculating the distances between the node embeddings and hypersphere center. The proposed method can effectively propagate label information on a small amount of nodes to unlabeled ones by taking into account the node's attributes, graph structure, and class imbalance. In experiments with five real-world attributed graph datasets, we demonstrate that the proposed method achieves better performance than various existing anomaly detection methods.

stat.ML↗
arXiv2020

Spatially Aggregated Gaussian Processes with Multivariate Areal Outputs

We propose a probabilistic model for inferring the multivariate function from multiple areal data sets with various granularities. Here, the areal data are observed not at location points but at regions. Existing regression-based models can only utilize the sufficiently fine-grained auxiliary data sets on the same domain (e.g., a city). With the proposed model, the functions for respective areal data sets are assumed to be a multivariate dependent Gaussian process (GP) that is modeled as a linear mixing of independent latent GPs. Sharing of latent GPs across multiple areal data sets allows us to effectively estimate the spatial correlation for each areal data set; moreover it can easily be extended to transfer learning across multiple domains. To handle the multivariate areal data, we design an observation model with a spatial aggregation process for each areal data set, which is an integral of the mixed GP over the corresponding region. By deriving the posterior GP, we can predict the data value at any location point by considering the spatial correlations and the dependences between areal data sets, simultaneously. Our experiments on real-world data sets demonstrate that our model can 1) accurately refine coarse-grained areal data, and 2) offer performance improvements by using the areal data sets from multiple domains.

stat.ML↗
arXiv2019

Variational Autoencoder with Implicit Optimal Priors

The variational autoencoder (VAE) is a powerful generative model that can estimate the probability of a data point by using latent variables. In the VAE, the posterior of the latent variable given the data point is regularized by the prior of the latent variable using Kullback Leibler (KL) divergence. Although the standard Gaussian distribution is usually used for the prior, this simple prior incurs over-regularization. As a sophisticated prior, the aggregated posterior has been introduced, which is the expectation of the posterior over the data distribution. This prior is optimal for the VAE in terms of maximizing the training objective function. However, KL divergence with the aggregated posterior cannot be calculated in a closed form, which prevents us from using this optimal prior. With the proposed method, we introduce the density ratio trick to estimate this KL divergence without modeling the aggregated posterior explicitly. Since the density ratio trick does not work well in high dimensions, we rewrite this KL divergence that contains the high-dimensional density ratio into the sum of the analytically calculable term and the low-dimensional density ratio term, to which the density ratio trick is applied. Experiments on various datasets show that the VAE with this implicit optimal prior achieves high density estimation performance.

stat.ML↗
arXiv2019

Efficient Transfer Bayesian Optimization with Auxiliary Information

We propose an efficient transfer Bayesian optimization method, which finds the maximum of an expensive-to-evaluate black-box function by using data on related optimization tasks. Our method uses auxiliary information that represents the task characteristics to effectively transfer knowledge for estimating a distribution over target functions. In particular, we use a Gaussian process, in which the mean and covariance functions are modeled with neural networks that simultaneously take both the auxiliary information and feature vectors as input. With a neural network mean function, we can estimate the target function even without evaluations. By using the neural network covariance function, we can extract nonlinear correlation among feature vectors that are shared across related tasks. Our Gaussian process-based formulation not only enables an analytic calculation of the posterior distribution but also swiftly adapts the target function to observations. Our method is also advantageous because the computational costs scale linearly with the number of source tasks. Through experiments using a synthetic dataset and datasets for finding the optimal pedestrian traffic regulations and optimal machine learning algorithms, we demonstrate that our method identifies the optimal points with fewer target function evaluations than existing methods.

stat.ML↗
arXiv2019

Anomaly Detection with Inexact Labels

We propose a supervised anomaly detection method for data with inexact anomaly labels, where each label, which is assigned to a set of instances, indicates that at least one instance in the set is anomalous. Although many anomaly detection methods have been proposed, they cannot handle inexact anomaly labels. To measure the performance with inexact anomaly labels, we define the inexact AUC, which is our extension of the area under the ROC curve (AUC) for inexact labels. The proposed method trains an anomaly score function so that the smooth approximation of the inexact AUC increases while anomaly scores for non-anomalous instances become low. We model the anomaly score function by a neural network-based unsupervised anomaly detection method, e.g., autoencoders. The proposed method performs well even when only a small number of inexact labels are available by incorporating an unsupervised anomaly detection mechanism with inexact AUC maximization. Using various datasets, we experimentally demonstrate that our proposed method improves the anomaly detection performance with inexact anomaly labels, and outperforms existing unsupervised and supervised anomaly detection and multiple instance learning methods.

stat.ML↗
arXiv2019

Refining Coarse-grained Spatial Data using Auxiliary Spatial Data Sets with Various Granularities

We propose a probabilistic model for refining coarse-grained spatial data by utilizing auxiliary spatial data sets. Existing methods require that the spatial granularities of the auxiliary data sets are the same as the desired granularity of target data. The proposed model can effectively make use of auxiliary data sets with various granularities by hierarchically incorporating Gaussian processes. With the proposed model, a distribution for each auxiliary data set on the continuous space is modeled using a Gaussian process, where the representation of uncertainty considers the levels of granularity. The fine-grained target data are modeled by another Gaussian process that considers both the spatial correlation and the auxiliary data sets with their uncertainty. We integrate the Gaussian process with a spatial aggregation process that transforms the fine-grained target data into the coarse-grained target data, by which we can infer the fine-grained target Gaussian process from the coarse-grained data. Our model is designed such that the inference of model parameters based on the exact marginal likelihood is possible, in which the variables of fine-grained target and auxiliary data are analytically integrated out. Our experiments on real-world spatial data sets demonstrate the effectiveness of the proposed model.

stat.ML↗
arXiv2019

Deep Mixture Point Processes: Spatio-temporal Event Prediction with Rich Contextual Information

Predicting when and where events will occur in cities, like taxi pick-ups, crimes, and vehicle collisions, is a challenging and important problem with many applications in fields such as urban planning, transportation optimization and location-based marketing. Though many point processes have been proposed to model events in a continuous spatio-temporal space, none of them allow for the consideration of the rich contextual factors that affect event occurrence, such as weather, social activities, geographical characteristics, and traffic. In this paper, we propose \textsf{DMPP} (Deep Mixture Point Processes), a point process model for predicting spatio-temporal events with the use of rich contextual information; a key advance is its incorporation of the heterogeneous and high-dimensional context available in image and text data. Specifically, we design the intensity of our point process model as a mixture of kernels, where the mixture weights are modeled by a deep neural network. This formulation allows us to automatically learn the complex nonlinear effects of the contextual factors on event occurrence. At the same time, this formulation makes analytical integration over the intensity, which is required for point process estimation, tractable. We use real-world data sets from different domains to demonstrate that DMPP has better predictive performance than existing methods.

stat.ML↗
arXiv2019

Supervised Anomaly Detection based on Deep Autoregressive Density Estimators

We propose a supervised anomaly detection method based on neural density estimators, where the negative log likelihood is used for the anomaly score. Density estimators have been widely used for unsupervised anomaly detection. By the recent advance of deep learning, the density estimation performance has been greatly improved. However, the neural density estimators cannot exploit anomaly label information, which would be valuable for improving the anomaly detection performance. The proposed method effectively utilizes the anomaly label information by training the neural density estimator so that the likelihood of normal instances is maximized and the likelihood of anomalous instances is lower than that of the normal instances. We employ an autoregressive model for the neural density estimator, which enables us to calculate the likelihood exactly. With the experiments using 16 datasets, we demonstrate that the proposed method improves the anomaly detection performance with a few labeled anomalous instances, and achieves better performance than existing unsupervised and supervised anomaly detection methods.

stat.ML↗
arXiv2019

Autoencoding Binary Classifiers for Supervised Anomaly Detection

We propose the Autoencoding Binary Classifiers (ABC), a novel supervised anomaly detector based on the Autoencoder (AE). There are two main approaches in anomaly detection: supervised and unsupervised. The supervised approach accurately detects the known anomalies included in training data, but it cannot detect the unknown anomalies. Meanwhile, the unsupervised approach can detect both known and unknown anomalies that are located away from normal data points. However, it does not detect known anomalies as accurately as the supervised approach. Furthermore, even if we have labeled normal data points and anomalies, the unsupervised approach cannot utilize these labels. The ABC is a probabilistic binary classifier that effectively exploits the label information, where normal data points are modeled using the AE as a component. By maximizing the likelihood, the AE in the proposed ABC is trained to minimize the reconstruction error for normal data points, and to maximize it for known anomalies. Since our approach becomes able to reconstruct the normal data points accurately and fails to reconstruct the known and unknown anomalies, it can accurately discriminate both known and unknown anomalies from normal data points. Experimental results show that the ABC achieves higher detection performance than existing supervised and unsupervised methods.

stat.ML↗
arXiv2018

Unsupervised Object Matching for Relational Data

We propose an unsupervised object matching method for relational data, which finds matchings between objects in different relational datasets without correspondence information. For example, the proposed method matches documents in different languages in multi-lingual document-word networks without dictionaries nor alignment information. The proposed method assumes that each object has latent vectors, and the probability of neighbor objects is modeled by the inner-product of the latent vectors, where the neighbors are generated by short random walks over the relations. The latent vectors are estimated by maximizing the likelihood of the neighbors for each dataset. The estimated latent vectors contain hidden structural information of each object in the given relational dataset. Then, the proposed method linearly projects the latent vectors for all the datasets onto a common latent space shared across all datasets by matching the distributions while preserving the structural information. The projection matrix is estimated by minimizing the distance between the latent vector distributions with an orthogonality regularizer. To represent the distributions effectively, we use the kernel embedding of distributions that hold high-order moment information about a distribution as an element in a reproducing kernel Hilbert space, which enables us to calculate the distance between the distributions without density estimation. The structural information encoded in the latent vectors are preserved by using the orthogonality regularizer. We demonstrate the effectiveness of the proposed method with experiments using real-world multi-lingual document-word relational datasets and multiple user-item relational datasets.

stat.ML↗
arXiv2018

Finding Appropriate Traffic Regulations via Graph Convolutional Networks

Appropriate traffic regulations, e.g. planned road closure, are important in congested events. Crowd simulators have been used to find appropriate regulations by simulating multiple scenarios with different regulations. However, this approach requires multiple simulation runs, which are time-consuming. In this paper, we propose a method to learn a function that outputs regulation effects given the current traffic situation as inputs. If the function is learned using the training data of many simulation runs in advance, we can obtain an appropriate regulation efficiently by bypassing simulations for the current situation. We use the graph convolutional networks for modeling the function, which enable us to find regulations even for unseen areas. With the proposed method, we construct a graph for each area, where a node represents a road, and an edge represents the road connection. By running crowd simulations with various regulations on various areas, we generate traffic situations and regulation effects. The graph convolutional networks are trained to output the regulation effects given the graph with the traffic situation information as inputs. With experiments using real-world road networks and a crowd simulator, we demonstrate that the proposed method can find a road to close that reduces the average time needed to reach the destination.

physics.soc-ph↗
arXiv2018

Unsupervised Cross-lingual Word Embedding by Multilingual Neural Language Models

We propose an unsupervised method to obtain cross-lingual embeddings without any parallel data or pre-trained word embeddings. The proposed model, which we call multilingual neural language models, takes sentences of multiple languages as an input. The proposed model contains bidirectional LSTMs that perform as forward and backward language models, and these networks are shared among all the languages. The other parameters, i.e. word embeddings and linear transformation between hidden states and outputs, are specific to each language. The shared LSTMs can capture the common sentence structure among all languages. Accordingly, word embeddings of each language are mapped into a common latent space, making it possible to measure the similarity of words across multiple languages. We evaluate the quality of the cross-lingual word embeddings on a word alignment task. Our experiments demonstrate that our model can obtain cross-lingual embeddings of much higher quality than existing unsupervised models when only a small amount of monolingual data (i.e. 50k sentences) are available, or the domains of monolingual data are different across languages.

cs.CL↗
arXiv2018

Zero-shot Domain Adaptation without Domain Semantic Descriptors

We propose a method to infer domain-specific models such as classifiers for unseen domains, from which no data are given in the training phase, without domain semantic descriptors. When training and test distributions are different, standard supervised learning methods perform poorly. Zero-shot domain adaptation attempts to alleviate this problem by inferring models that generalize well to unseen domains by using training data in multiple source domains. Existing methods use observed semantic descriptors characterizing domains such as time information to infer the domain-specific models for the unseen domains. However, it cannot always be assumed that such metadata can be used in real-world applications. The proposed method can infer appropriate domain-specific models without any semantic descriptors by introducing the concept of latent domain vectors, which are latent representations for the domains and are used for inferring the models. The latent domain vector for the unseen domain is inferred from the set of the feature vectors in the corresponding domain, which is given in the testing phase. The domain-specific models consist of two components: the first is for extracting a representation of a feature vector to be predicted, and the second is for inferring model parameters given the latent domain vector. The posterior distributions of the latent domain vectors and the domain-specific models are parametrized by neural networks, and are optimized by maximizing the variational lower bound using stochastic gradient descent. The effectiveness of the proposed method was demonstrated through experiments using one regression and two classification tasks.

stat.ML↗
arXiv2018

Few-shot learning of neural networks from scratch by pseudo example optimization

In this paper, we propose a simple but effective method for training neural networks with a limited amount of training data. Our approach inherits the idea of knowledge distillation that transfers knowledge from a deep or wide reference model to a shallow or narrow target model. The proposed method employs this idea to mimic predictions of reference estimators that are more robust against overfitting than the network we want to train. Different from almost all the previous work for knowledge distillation that requires a large amount of labeled training data, the proposed method requires only a small amount of training data. Instead, we introduce pseudo training examples that are optimized as a part of model parameters. Experimental results for several benchmark datasets demonstrate that the proposed method outperformed all the other baselines, such as naive training of the target model and standard knowledge distillation.

stat.ML↗
arXiv2017

Improving Output Uncertainty Estimation and Generalization in Deep Learning via Neural Network Gaussian Processes

We propose a simple method that combines neural networks and Gaussian processes. The proposed method can estimate the uncertainty of outputs and flexibly adjust target functions where training data exist, which are advantages of Gaussian processes. The proposed method can also achieve high generalization performance for unseen input configurations, which is an advantage of neural networks. With the proposed method, neural networks are used for the mean functions of Gaussian processes. We present a scalable stochastic inference procedure, where sparse Gaussian processes are inferred by stochastic variational inference, and the parameters of neural networks and kernels are estimated by stochastic gradient descent methods, simultaneously. We use two real-world spatio-temporal data sets to demonstrate experimentally that the proposed method achieves better uncertainty estimation and generalization performance than neural networks and Gaussian processes.

stat.ML↗
arXiv2016

Localized Lasso for High-Dimensional Regression

We introduce the localized Lasso, which is suited for learning models that are both interpretable and have a high predictive power in problems with high dimensionality $d$ and small sample size $n$. More specifically, we consider a function defined by local sparse models, one at each data point. We introduce sample-wise network regularization to borrow strength across the models, and sample-wise exclusive group sparsity (a.k.a., $\ell_{1,2}$ norm) to introduce diversity into the choice of feature sets in the local models. The local models are interpretable in terms of similarity of their sparsity patterns. The cost function is convex, and thus has a globally optimal solution. Moreover, we propose a simple yet efficient iterative least-squares based optimization procedure for the localized Lasso, which does not need a tuning parameter, and is guaranteed to converge to a globally optimal solution. The solution is empirically shown to outperform alternatives for both simulated and genomic personalized medicine data.

stat.ML↗