pwc-archive/papers-with-abstracts huggingface dataset:
Multitask Learning for Time Series Data with 2D Convolution
Authors: Chin-Chia Michael Yeh, Xin Dai, Yan Zheng, Junpeng Wang, Huiyuan Chen, Yujie Fan, Audrey Der, Zhongfang Zhuang, Liang Wang, Wei zhang
Date: 2023-10-05 00:00:00
Tasks: Dynamic Time Warping, Recommendation Systems, Time Series, Time Series Classification

Multitask learning (MTL) aims to develop a unified model that can handle a set of closely related tasks simultaneously. By optimizing the model across multiple tasks, MTL generally surpasses its non-MTL counterparts in terms of generalizability. Although MTL has been extensively researched in various domains such as computer vision, natural language processing, and recommendation systems, its application to time series data has received limited attention. In this paper, we investigate the application of MTL to the time series classification (TSC) problem. However, when we integrate the state-of-the-art 1D convolution-based TSC model with MTL, the performance of the TSC model actually deteriorates. By comparing the 1D convolution-based models with the Dynamic Time Warping (DTW) distance function, it appears that the underwhelming results stem from the limited expressive power of the 1D convolutional layers. To overcome this challenge, we propose a novel design for a 2D convolution-based model that enhances the model's expressiveness. Leveraging this advantage, our proposed method outperforms competing approaches on both the UCR Archive and an industrial transaction TSC dataset.
An Efficient Content-based Time Series Retrieval System
Authors: Chin-Chia Michael Yeh, Huiyuan Chen, Xin Dai, Yan Zheng, Junpeng Wang, Vivian Lai, Yujie Fan, Audrey Der, Zhongfang Zhuang, Liang Wang, Wei zhang, Jeff M. Phillips
Date: 2023-10-05 00:00:00
Tasks: Information Retrieval, Retrieval, Time Series

A Content-based Time Series Retrieval (CTSR) system is an information retrieval system for users to interact with time series emerged from multiple domains, such as finance, healthcare, and manufacturing. For example, users seeking to learn more about the source of a time series can submit the time series as a query to the CTSR system and retrieve a list of relevant time series with associated metadata. By analyzing the retrieved metadata, users can gather more information about the source of the time series. Because the CTSR system is required to work with time series data from diverse domains, it needs a high-capacity model to effectively measure the similarity between different time series. On top of that, the model within the CTSR system has to compute the similarity scores in an efficient manner as the users interact with the system in real-time. In this paper, we propose an effective and efficient CTSR model that outperforms alternative models, while still providing reasonable inference runtimes. To demonstrate the capability of the proposed method in solving business problems, we compare it against alternative models using our in-house transaction data. Our findings reveal that the proposed model is the most suitable solution compared to others for our transaction data problem.
Toward a Foundation Model for Time Series Data
Authors: Chin-Chia Michael Yeh, Xin Dai, Huiyuan Chen, Yan Zheng, Yujie Fan, Audrey Der, Vivian Lai, Zhongfang Zhuang, Junpeng Wang, Liang Wang, Wei zhang
Date: 2023-10-05 00:00:00
Tasks: model, Self-Supervised Learning, Time Series

A foundation model is a machine learning model trained on a large and diverse set of data, typically using self-supervised learning-based pre-training techniques, that can be adapted to various downstream tasks. However, current research on time series pre-training has mostly focused on models pre-trained solely on data from a single domain, resulting in a lack of knowledge about other types of time series. However, current research on time series pre-training has predominantly focused on models trained exclusively on data from a single domain. As a result, these models possess domain-specific knowledge that may not be easily transferable to time series from other domains. In this paper, we aim to develop an effective time series foundation model by leveraging unlabeled samples from multiple domains. To achieve this, we repurposed the publicly available UCR Archive and evaluated four existing self-supervised learning-based pre-training methods, along with a novel method, on the datasets. We tested these methods using four popular neural network architectures for time series to understand how the pre-training methods interact with different network designs. Our experimental results show that pre-training improves downstream classification tasks by enhancing the convergence of the fine-tuning process. Furthermore, we found that the proposed pre-training method, when combined with the Transformer model, outperforms the alternatives.
Leveraging Low-Rank and Sparse Recurrent Connectivity for Robust Closed-Loop Control
Authors: Neehal Tumma, Mathias Lechner, Noel Loo, Ramin Hasani, Daniela Rus
Date: 2023-10-05 00:00:00

Developing autonomous agents that can interact with changing environments is an open challenge in machine learning. Robustness is particularly important in these settings as agents are often fit offline on expert demonstrations but deployed online where they must generalize to the closed feedback loop within the environment. In this work, we explore the application of recurrent neural networks to tasks of this nature and understand how a parameterization of their recurrent connectivity influences robustness in closed-loop settings. Specifically, we represent the recurrent connectivity as a function of rank and sparsity and show both theoretically and empirically that modulating these two variables has desirable effects on network dynamics. The proposed low-rank, sparse connectivity induces an interpretable prior on the network that proves to be most amenable for a class of models known as closed-form continuous-time neural networks (CfCs). We find that CfCs with fewer parameters can outperform their full-rank, fully-connected counterparts in the online setting under distribution shift. This yields memory-efficient and robust agents while opening a new perspective on how we can modulate network dynamics through connectivity.
RTDK-BO: High Dimensional Bayesian Optimization with Reinforced Transformer Deep kernels
Authors: Alexander Shmakov, Avisek Naug, Vineet Gundecha, Sahand Ghorbanpour, Ricardo Luna Gutierrez, Ashwin Ramesh Babu, Antonio Guillen, Soumyendu Sarkar
Date: 2023-10-05 00:00:00
Tasks: Bayesian Optimization, Meta-Learning, reinforcement-learning, Reinforcement Learning, Reinforcement Learning (RL)

Bayesian Optimization (BO), guided by Gaussian process (GP) surrogates, has proven to be an invaluable technique for efficient, high-dimensional, black-box optimization, a critical problem inherent to many applications such as industrial design and scientific computing. Recent contributions have introduced reinforcement learning (RL) to improve the optimization performance on both single function optimization and \textit{few-shot} multi-objective optimization. However, even few-shot techniques fail to exploit similarities shared between closely related objectives. In this paper, we combine recent developments in Deep Kernel Learning (DKL) and attention-based Transformer models to improve the modeling powers of GP surrogates with meta-learning. We propose a novel method for improving meta-learning BO surrogates by incorporating attention mechanisms into DKL, empowering the surrogates to adapt to contextual information gathered during the BO process. We combine this Transformer Deep Kernel with a learned acquisition function trained with continuous Soft Actor-Critic Reinforcement Learning to aid in exploration. This Reinforced Transformer Deep Kernel (RTDK-BO) approach yields state-of-the-art results in continuous high-dimensional optimization problems.
PyDCM: Custom Data Center Models with Reinforcement Learning for Sustainability
Authors: Avisek Naug, Antonio Guillen, Ricardo Luna Gutiérrez, Vineet Gundecha, Dejan Markovikj, Lekhapriya Dheeraj Kashyap, Lorenz Krause, Sahand Ghorbanpour, Sajad Mousavi, Ashwin Ramesh Babu, Soumyendu Sarkar
Date: 2023-10-05 00:00:00
Tasks: Deep Reinforcement Learning, reinforcement-learning, Reinforcement Learning

The increasing global emphasis on sustainability and reducing carbon emissions is pushing governments and corporations to rethink their approach to data center design and operation. Given their high energy consumption and exponentially large computational workloads, data centers are prime candidates for optimizing power consumption, especially in areas such as cooling and IT energy usage. A significant challenge in this pursuit is the lack of a configurable and scalable thermal data center model that offers an end-to-end pipeline. Data centers consist of multiple IT components whose geometric configuration and heat dissipation make thermal modeling difficult. This paper presents PyDCM, a customizable Data Center Model implemented in Python, that allows users to create unique configurations of IT equipment with custom server specifications and geometric arrangements of IT cabinets. The use of vectorized thermal calculations makes PyDCM orders of magnitude faster (30 times) than current Energy Plus modeling implementations and scales sublinearly with the number of CPUs. Also, PyDCM enables the use of Deep Reinforcement Learning via the Gymnasium wrapper to optimize data center cooling and offers a user-friendly platform for testing various data center design prototypes.
CrysFormer: Protein Structure Prediction via 3d Patterson Maps and Partial Structure Attention
Authors: Chen Dun, Qiutai Pan, Shikai Jin, Ria Stevens, Mitchell D. Miller, George N. Phillips, Jr., Anastasios Kyrillidis
Date: 2023-10-05 00:00:00
Tasks: Protein Structure Prediction

Determining the structure of a protein has been a decades-long open question. A protein's three-dimensional structure often poses nontrivial computation costs, when classical simulation algorithms are utilized. Advances in the transformer neural network architecture -- such as AlphaFold2 -- achieve significant improvements for this problem, by learning from a large dataset of sequence information and corresponding protein structures. Yet, such methods only focus on sequence information; other available prior knowledge, such as protein crystallography and partial structure of amino acids, could be potentially utilized. To the best of our knowledge, we propose the first transformer-based model that directly utilizes protein crystallography and partial structure information to predict the electron density maps of proteins. Via two new datasets of peptide fragments (2-residue and 15-residue) , we demonstrate our method, dubbed \texttt{CrysFormer}, can achieve accurate predictions, based on a much smaller dataset size and with reduced computation costs.
Class-Incremental Learning Using Generative Experience Replay Based on Time-aware Regularization
Authors: Zizhao Hu, Mohammad Rostami
Date: 2023-10-05 00:00:00
Tasks: class-incremental learning, Class Incremental Learning, Continual Learning, Incremental Learning

Learning new tasks accumulatively without forgetting remains a critical challenge in continual learning. Generative experience replay addresses this challenge by synthesizing pseudo-data points for past learned tasks and later replaying them for concurrent training along with the new tasks' data. Generative replay is the best strategy for continual learning under a strict class-incremental setting when certain constraints need to be met: (i) constant model size, (ii) no pre-training dataset, and (iii) no memory buffer for storing past tasks' data. Inspired by the biological nervous system mechanisms, we introduce a time-aware regularization method to dynamically fine-tune the three training objective terms used for generative replay: supervised learning, latent regularization, and data reconstruction. Experimental results on major benchmarks indicate that our method pushes the limit of brain-inspired continual learners under such strict settings, improves memory retention, and increases the average performance over continually arriving tasks.
Accelerated Neural Network Training with Rooted Logistic Objectives
Authors: Zhu Wang, Praveen Raj Veluswami, Harsh Mishra, Sathya N. Ravi
Date: 2023-10-05 00:00:00
Tasks: Binary Classification, Data Augmentation

Many neural networks deployed in the real world scenarios are trained using cross entropy based loss functions. From the optimization perspective, it is known that the behavior of first order methods such as gradient descent crucially depend on the separability of datasets. In fact, even in the most simplest case of binary classification, the rate of convergence depends on two factors: (1) condition number of data matrix, and (2) separability of the dataset. With no further pre-processing techniques such as over-parametrization, data augmentation etc., separability is an intrinsic quantity of the data distribution under consideration. We focus on the landscape design of the logistic function and derive a novel sequence of {\em strictly} convex functions that are at least as strict as logistic loss. The minimizers of these functions coincide with those of the minimum norm solution wherever possible. The strict convexity of the derived function can be extended to finetune state-of-the-art models and applications. In empirical experimental analysis, we apply our proposed rooted logistic objective to multiple deep models, e.g., fully-connected neural networks and transformers, on various of classification benchmarks. Our results illustrate that training with rooted loss function is converged faster and gains performance improvements. Furthermore, we illustrate applications of our novel rooted loss function in generative modeling based downstream applications, such as finetuning StyleGAN model with the rooted loss. The code implementing our losses and models can be found here for open source software development purposes: https://anonymous.4open.science/r/rooted_loss.
Information Geometry for the Working Information Theorist
Authors: Kumar Vijay Mishra, M. Ashok Kumar, Ting-Kam Leonard Wong
Date: 2023-10-05 00:00:00

Information geometry is a study of statistical manifolds, that is, spaces of probability distributions from a geometric perspective. Its classical information-theoretic applications relate to statistical concepts such as Fisher information, sufficient statistics, and efficient estimators. Today, information geometry has emerged as an interdisciplinary field that finds applications in diverse areas such as radar sensing, array signal processing, quantum physics, deep learning, and optimal transport. This article presents an overview of essential information geometry to initiate an information theorist, who may be unfamiliar with this exciting area of research. We explain the concepts of divergences on statistical manifolds, generalized notions of distances, orthogonality, and geodesics, thereby paving the way for concrete applications and novel theoretical investigations. We also highlight some recent information-geometric developments, which are of interest to the broader information theory community.
Small batch deep reinforcement learning
Date: 2023-10-05 00:00:00
Proceeding: NeurIPS 2023 11
Tasks: Deep Reinforcement Learning, reinforcement-learning, Reinforcement Learning

In value-based deep reinforcement learning with replay memories, the batch size parameter specifies how many transitions to sample for each gradient update. Although critical to the learning process, this value is typically not adjusted when proposing new algorithms. In this work we present a broad empirical study that suggests {\em reducing} the batch size can result in a number of significant performance gains; this is surprising, as the general tendency when training neural networks is towards larger batch sizes for improved performance. We complement our experimental findings with a set of empirical analyses towards better understanding this phenomenon.
Non Commutative Convolutional Signal Models in Neural Networks: Stability to Small Deformations
Authors: Alejandro Parada-Mayorga, Landon Butler, Alejandro Ribeiro
Date: 2023-10-05 00:00:00

In this paper we discuss the results recently published in~[1] about algebraic signal models (ASMs) based on non commutative algebras and their use in convolutional neural networks. Relying on the general tools from algebraic signal processing (ASP), we study the filtering and stability properties of non commutative convolutional filters. We show how non commutative filters can be stable to small perturbations on the space of operators. We also show that although the spectral components of the Fourier representation in a non commutative signal model are associated to spaces of dimension larger than one, there is a trade-off between stability and selectivity similar to that observed for commutative models. Our results have direct implications for group neural networks, multigraph neural networks and quaternion neural networks, among other non commutative architectures. We conclude by corroborating these results through numerical experiments.
Model Complexity of Program Phases
Authors: Arjun Karuvally, J. Eliot B. Moss
Date: 2023-10-05 00:00:00
Tasks: model, Prediction

In resource limited computing systems, sequence prediction models must operate under tight constraints. Various models are available that cater to prediction under these conditions that in some way focus on reducing the cost of implementation. These resource constrained sequence prediction models, in practice, exhibit a fundamental tradeoff between the cost of implementation and the quality of its predictions. This fundamental tradeoff seems to be largely unexplored for models for different tasks. Here we formulate the necessary theory and an associated empirical procedure to explore this tradeoff space for a particular family of machine learning models such as deep neural networks. We anticipate that the knowledge of the behavior of this tradeoff may be beneficial in understanding the theoretical and practical limits of creation and deployment of models for resource constrained tasks.
Variational Barycentric Coordinates
Authors: Ana Dodik, Oded Stein, Vincent Sitzmann, Justin Solomon
Date: 2023-10-05 00:00:00
Tasks: valid

We propose a variational technique to optimize for generalized barycentric coordinates that offers additional control compared to existing models. Prior work represents barycentric coordinates using meshes or closed-form formulae, in practice limiting the choice of objective function. In contrast, we directly parameterize the continuous function that maps any coordinate in a polytope's interior to its barycentric coordinates using a neural field. This formulation is enabled by our theoretical characterization of barycentric coordinates, which allows us to construct neural fields that parameterize the entire function class of valid coordinates. We demonstrate the flexibility of our model using a variety of objective functions, including multiple smoothness and deformation-aware energies; as a side contribution, we also present mathematically-justified means of measuring and minimizing objectives like total variation on discontinuous neural fields. We offer a practical acceleration strategy, present a thorough validation of our algorithm, and demonstrate several applications.
OpenIncrement: A Unified Framework for Open Set Recognition and Deep Class-Incremental Learning
Authors: Jiawen Xu, Claas Grohnfeldt, Odej Kao
Date: 2023-10-05 00:00:00
Tasks: class-incremental learning, Class Incremental Learning, Incremental Learning, Open Set Learning

In most works on deep incremental learning research, it is assumed that novel samples are pre-identified for neural network retraining. However, practical deep classifiers often misidentify these samples, leading to erroneous predictions. Such misclassifications can degrade model performance. Techniques like open set recognition offer a means to detect these novel samples, representing a significant area in the machine learning domain. In this paper, we introduce a deep class-incremental learning framework integrated with open set recognition. Our approach refines class-incrementally learned features to adapt them for distance-based open set recognition. Experimental results validate that our method outperforms state-of-the-art incremental learning techniques and exhibits superior performance in open set recognition compared to baseline methods.
Less is More: On the Feature Redundancy of Pretrained Models When Transferring to Few-shot Tasks
Authors: Xu Luo, Difan Zou, Lianli Gao, Zenglin Xu, Jingkuan Song
Date: 2023-10-05 00:00:00
Tasks: Feature Importance

Transferring a pretrained model to a downstream task can be as easy as conducting linear probing with target data, that is, training a linear classifier upon frozen features extracted from the pretrained model. As there may exist significant gaps between pretraining and downstream datasets, one may ask whether all dimensions of the pretrained features are useful for a given downstream task. We show that, for linear probing, the pretrained features can be extremely redundant when the downstream data is scarce, or few-shot. For some cases such as 5-way 1-shot tasks, using only 1\% of the most important feature dimensions is able to recover the performance achieved by using the full representation. Interestingly, most dimensions are redundant only under few-shot settings and gradually become useful when the number of shots increases, suggesting that feature redundancy may be the key to characterizing the "few-shot" nature of few-shot transfer problems. We give a theoretical understanding of this phenomenon and show how dimensions with high variance and small distance between class centroids can serve as confounding factors that severely disturb classification results under few-shot settings. As an attempt at solving this problem, we find that the redundant features are difficult to identify accurately with a small number of training samples, but we can instead adjust feature magnitude with a soft mask based on estimated feature importance. We show that this method can generally improve few-shot transfer performance across various pretrained models and downstream datasets.
Contextualized Structural Self-supervised Learning for Ontology Matching
Authors: Zhu Wang
Date: 2023-10-05 00:00:00
Tasks: Graph Embedding, Knowledge Graph Embedding, Knowledge Graphs, Ontology Matching, Self-Supervised Learning

Ontology matching (OM) entails the identification of semantic relationships between concepts within two or more knowledge graphs (KGs) and serves as a critical step in integrating KGs from various sources. Recent advancements in deep OM models have harnessed the power of transformer-based language models and the advantages of knowledge graph embedding. Nevertheless, these OM models still face persistent challenges, such as a lack of reference alignments, runtime latency, and unexplored different graph structures within an end-to-end framework. In this study, we introduce a novel self-supervised learning OM framework with input ontologies, called LaKERMap. This framework capitalizes on the contextual and structural information of concepts by integrating implicit knowledge into transformers. Specifically, we aim to capture multiple structural contexts, encompassing both local and global interactions, by employing distinct training objectives. To assess our methods, we utilize the Bio-ML datasets and tasks. The findings from our innovative approach reveal that LaKERMap surpasses state-of-the-art systems in terms of alignment quality and inference time. Our models and codes are available here: https://github.com/ellenzhuwang/lakermap.