An interpretable comparison of generative models requires the identification of sample types produced more frequently by each of the involved models. While several quantitative scores have been proposed in the literature to rank different generative models, such score-based evaluations do not reveal the nuanced differences between the generative models in capturing various sample types. In this work, we attempt to solve a differential clustering problem to detect sample types expressed differently by two generative models. To solve the differential clustering problem, we propose a method called Fourier-based Identification of Novel Clusters (FINC) to identify modes produced by a generative model with a higher frequency in comparison to a reference distribution. FINC provides a scalable stochastic algorithm based on random Fourier features to estimate the eigenspace of kernel covariance matrices of two generative models and utilize the principal eigendirections to detect the sample types present more dominantly in each model. We demonstrate the application of the FINC method to large-scale computer vision datasets and generative model frameworks. Our numerical results suggest the scalability of the developed Fourier-based method in highlighting the sample types produced with different frequencies by widely-used generative models. Code is available at \url{https://github.com/buyeah1109/FINC}

The use of implicit time-stepping schemes for the numerical approximation of solutions to stiff nonlinear time-evolution equations brings well-known advantages including, typically, better stability behaviour and corresponding support of larger time steps, and better structure preservation properties. However, this comes at the price of having to solve a nonlinear equation at every time step of the numerical scheme. In this work, we propose a novel operator learning based hybrid Newton's method to accelerate this solution of the nonlinear time step system for stiff time-evolution nonlinear equations. We propose a targeted learning strategy which facilitates robust unsupervised learning in an offline phase and provides a highly efficient initialisation for the Newton iteration leading to consistent acceleration of Newton's method. A quantifiable rate of improvement in Newton's method achieved by improved initialisation is provided and we analyse the upper bound of the generalisation error of our unsupervised learning strategy. These theoretical results are supported by extensive numerical results, demonstrating the efficiency of our proposed neural hybrid solver both in one- and two-dimensional cases.

In the wake of rapid advancements in artificial intelligence (AI), we stand on the brink of a transformative leap in data systems. The imminent fusion of AI and DB (AIxDB) promises a new generation of data systems, which will relieve the burden on end-users across all industry sectors by featuring AI-enhanced functionalities, such as personalized and automated in-database AI-powered analytics, self-driving capabilities for improved system performance, etc. In this paper, we explore the evolution of data systems with a focus on deepening the fusion of AI and DB. We present NeurDB, an AI-powered autonomous data system designed to fully embrace AI design in each major system component and provide in-database AI-powered analytics. We outline the conceptual and architectural overview of NeurDB, discuss its design choices and key components, and report its current development and future plan.

Policy gradient (PG) is a reinforcement learning (RL) approach that optimizes a parameterized policy model for an expected return using gradient ascent. While PG can work well even in non-Markovian environments, it may encounter plateaus or peakiness issues. As another successful RL approach, algorithms based on Monte Carlo Tree Search (MCTS), which include AlphaZero, have obtained groundbreaking results, especially in the game-playing domain. They are also effective when applied to non-Markov decision processes. However, the standard MCTS is a method for decision-time planning, which differs from the online RL setting. In this work, we first introduce Monte Carlo Tree Learning (MCTL), an adaptation of MCTS for online RL setups. We then explore a combined policy approach of PG and MCTL to leverage their strengths. We derive conditions for asymptotic convergence with the results of a two-timescale stochastic approximation and propose an algorithm that satisfies these conditions and converges to a reasonable solution. Our numerical experiments validate the effectiveness of the proposed methods.

While content-based image retrieval (CBIR) has been extensively studied in natural image retrieval, its application to medical images presents ongoing challenges, primarily due to the 3D nature of medical images. Recent studies have shown the potential use of pre-trained vision embeddings for CBIR in the context of radiology image retrieval. However, a benchmark for the retrieval of 3D volumetric medical images is still lacking, hindering the ability to objectively evaluate and compare the efficiency of proposed CBIR approaches in medical imaging. In this study, we extend previous work and establish a benchmark for region-based and localized multi-organ retrieval using the TotalSegmentator dataset (TS) with detailed multi-organ annotations. We benchmark embeddings derived from pre-trained supervised models on medical images against embeddings derived from pre-trained unsupervised models on non-medical images for 29 coarse and 104 detailed anatomical structures in volume and region levels. For volumetric image retrieval, we adopt a late interaction re-ranking method inspired by text matching. We compare it against the original method proposed for volume and region retrieval and achieve a retrieval recall of 1.0 for diverse anatomical regions with a wide size range. The findings and methodologies presented in this paper provide insights and benchmarks for further development and evaluation of CBIR approaches in the context of medical imaging.

Pre-training followed by fine-tuning is widely adopted among practitioners. The performance can be improved by "model soups"~\cite{wortsman2022model} via exploring various hyperparameter configurations.The Learned-Soup, a variant of model soups, significantly improves the performance but suffers from substantial memory and time costs due to the requirements of (i) having to load all fine-tuned models simultaneously, and (ii) a large computational graph encompassing all fine-tuned models. In this paper, we propose Memory Efficient Hyperplane Learned Soup (MEHL-Soup) to tackle this issue by formulating the learned soup as a hyperplane optimization problem and introducing block coordinate gradient descent to learn the mixing coefficients. At each iteration, MEHL-Soup only needs to load a few fine-tuned models and build a computational graph with one combined model. We further extend MEHL-Soup to MEHL-Soup+ in a layer-wise manner. Experimental results on various ViT models and data sets show that MEHL-Soup(+) outperforms Learned-Soup(+) in terms of test accuracy, and also reduces memory usage by more than $13\times$. Moreover, MEHL-Soup(+) can be run on a single GPU and achieves $9\times$ speed up in soup construction compared with the Learned-Soup. The code is released at https://github.com/nblt/MEHL-Soup.

Neural networks surround us, in the form of large language models, speech transcription systems, molecular discovery algorithms, robotics, and much more. Stripped of anything else, neural networks are compositions of differentiable primitives, and studying them means learning how to program and how to interact with these models, a particular example of what is called differentiable programming. This primer is an introduction to this fascinating field imagined for someone, like Alice, who has just ventured into this strange differentiable wonderland. I overview the basics of optimizing a function via automatic differentiation, and a selection of the most common designs for handling sequences, graphs, texts, and audios. The focus is on a intuitive, self-contained introduction to the most important design techniques, including convolutional, attentional, and recurrent blocks, hoping to bridge the gap between theory and code (PyTorch and JAX) and leaving the reader capable of understanding some of the most advanced models out there, such as large language models (LLMs) and multimodal architectures.

Monitoring the stress level in patients with neurodegenerative diseases can help manage symptoms, improve patient's quality of life, and provide insight into disease progression. In the literature, ECG, actigraphy, speech, voice, and facial analysis have proven effective at detecting patients' emotions. On the other hand, these tools are invasive and do not integrate smoothly into the patient's daily life. HRV has also been proven to effectively indicate stress conditions, especially in combination with other signals. However, when HRV is derived from less invasive devices than the ECG, like smartwatches and bracelets, the quality of measurements significantly degrades. This paper presents a methodology for stress detection from a smartwatch based on a universal model for time series, UniTS, which we fine-tuned for the task. We cast the problem as anomaly detection rather than classification to favor model adaptation to individual patients and allow the clinician to maintain greater control over the system's predictions. We demonstrate that our proposed model considerably surpasses 12 top-performing methods on 3 benchmark datasets. Furthermore, unlike other state-of-the-art systems, UniTS enables seamless monitoring, as it shows comparable performance when using signals from invasive or lightweight devices.

Tabular data is one of the most common data sources in machine learning. Although a wide range of classical methods demonstrate practical utilities in this field, deep learning methods on tabular data are becoming promising alternatives due to their flexibility and ability to capture complex interactions within the data. Considering that deep tabular methods have diverse design philosophies, including the ways they handle features, design learning objectives, and construct model architectures, we introduce a versatile deep-learning toolbox called Talent (Tabular Analytics and LEarNing Toolbox) to utilize, analyze, and compare tabular methods. Talent encompasses an extensive collection of more than 20 deep tabular prediction methods, associated with various encoding and normalization modules, and provides a unified interface that is easily integrable with new methods as they emerge. In this paper, we present the design and functionality of the toolbox, illustrate its practical application through several case studies, and investigate the performance of various methods fairly based on our toolbox.

There has been a large number of studies in interpretable and explainable ML for cybersecurity, in particular, for intrusion detection. Many of these studies have significant amount of overlapping and repeated evaluations and analysis. At the same time, these studies overlook crucial model, data, learning process, and utility related issues and many times completely disregard them. These issues include the use of overly complex and opaque ML models, unaccounted data imbalances and correlated features, inconsistent influential features across different explanation methods, the inconsistencies stemming from the constituents of a learning process, and the implausible utility of explanations. In this work, we empirically demonstrate these issues, analyze them and propose practical solutions in the context of feature-based model explanations. Specifically, we advise avoiding complex opaque models such as Deep Neural Networks and instead using interpretable ML models such as Decision Trees as the available intrusion datasets are not difficult for such interpretable models to classify successfully. Then, we bring attention to the binary classification metrics such as Matthews Correlation Coefficient (which are well-suited for imbalanced datasets. Moreover, we find that feature-based model explanations are most often inconsistent across different settings. In this respect, to further gauge the extent of inconsistencies, we introduce the notion of cross explanations which corroborates that the features that are determined to be impactful by one explanation method most often differ from those by another method. Furthermore, we show that strongly correlated data features and the constituents of a learning process, such as hyper-parameters and the optimization routine, become yet another source of inconsistent explanations. Finally, we discuss the utility of feature-based explanations.