In this note we present a fully information theoretic approach to renormalization inspired by Bayesian statistical inference, which we refer to as Bayesian Renormalization. The main insight of Bayesian Renormalization is that the Fisher metric defines a correlation length that plays the role of an emergent RG scale quantifying the distinguishability between nearby points in the space of probability distributions. This RG scale can be interpreted as a proxy for the maximum number of unique observations that can be made about a given system during a statistical inference experiment. The role of the Bayesian Renormalization scheme is subsequently to prepare an effective model for a given system up to a precision which is bounded by the aforementioned scale. In applications of Bayesian Renormalization to physical systems, the emergent information theoretic scale is naturally identified with the maximum energy that can be probed by current experimental apparatus, and thus Bayesian Renormalization coincides with ordinary renormalization. However, Bayesian Renormalization is sufficiently general to apply even in circumstances in which an immediate physical scale is absent, and thus provides an ideal approach to renormalization in data science contexts. To this end, we provide insight into how the Bayesian Renormalization scheme relates to existing methods for data compression and data generation such as the information bottleneck and the diffusion learning paradigm. We conclude by designing an explicit form of Bayesian Renormalization inspired by Wilson's momentum shell renormalization scheme in Quantum Field Theory. We apply this Bayesian Renormalization scheme to a simple Neural Network and verify the sense in which it organizes the parameters of the model according to a hierarchy of information theoretic importance.

Training a modern machine learning architecture on a new task requires extensive learning-rate tuning, which comes at a high computational cost. Here we develop new adaptive learning rates that can be used with any momentum method, and require less tuning to perform well. We first develop MoMo, a Momentum Model based adaptive learning rate for SGD-M (Stochastic gradient descent with momentum). MoMo uses momentum estimates of the batch losses and gradients sampled at each iteration to build a model of the loss function. Our model also makes use of any known lower bound of the loss function by using truncation, e.g. most losses are lower-bounded by zero. We then approximately minimize this model at each iteration to compute the next step. We show how MoMo can be used in combination with any momentum-based method, and showcase this by developing MoMo-Adam - which is Adam with our new model-based adaptive learning rate. Additionally, for losses with unknown lower bounds, we develop on-the-fly estimates of a lower bound, that are incorporated in our model. Through extensive numerical experiments, we demonstrate that MoMo and MoMo-Adam improve over SGD-M and Adam in terms of accuracy and robustness to hyperparameter tuning for training image classifiers on MNIST, CIFAR10, CIFAR100, Imagenet, recommender systems on the Criteo dataset, and a transformer model on the translation task IWSLT14.

Knowledge graphs (KGs) are a popular way to organise information based on ontologies or schemas and have been used across a variety of scenarios from search to recommendation. Despite advances in KGs, representing knowledge remains a non-trivial task across industries and it is especially challenging in the biomedical and healthcare domains due to complex interdependent relations between entities, heterogeneity, lack of standardization, and sparseness of data. KGs are used to discover diagnoses or prioritize genes relevant to disease, but they often rely on schemas that are not centred around a node or entity of interest, such as a person. Entity-centric KGs are relatively unexplored but hold promise in representing important facets connected to a central node and unlocking downstream tasks beyond graph traversal and reasoning, such as generating graph embeddings and training graph neural networks for a wide range of predictive tasks. This paper presents an end-to-end representation learning framework to extract entity-centric KGs from structured and unstructured data. We introduce a star-shaped ontology to represent the multiple facets of a person and use it to guide KG creation. Compact representations of the graphs are created leveraging graph neural networks and experiments are conducted using different levels of heterogeneity or explicitness. A readmission prediction task is used to evaluate the results of the proposed framework, showing a stable system, robust to missing data, that outperforms a range of baseline machine learning classifiers. We highlight that this approach has several potential applications across domains and is open-sourced. Lastly, we discuss lessons learned, challenges, and next steps for the adoption of the framework in practice.

The K Nearest Neighbors (KNN) classifier is widely used in many fields such as fingerprint-based localization or medicine. It determines the class membership of unlabelled sample based on the class memberships of the K labelled samples, the so-called nearest neighbors, that are closest to the unlabelled sample. The choice of K has been the topic of various studies and proposed KNN-variants. Yet no variant has been proven to outperform all other variants. In this paper a new KNN-variant is proposed which ensures that the K nearest neighbors are indeed close to the unlabelled sample and finds K along the way. The proposed algorithm is tested and compared to the standard KNN in theoretical scenarios and for indoor localization based on ion-mobility spectrometry fingerprints. It achieves a higher classification accuracy than the KNN in the tests, while requiring having the same computational demand.

Deep Ensembles are a simple, reliable, and effective method of improving both the predictive performance and uncertainty estimates of deep learning approaches. However, they are widely criticised as being computationally expensive, due to the need to deploy multiple independent models. Recent work has challenged this view, showing that for predictive accuracy, ensembles can be more computationally efficient (at inference) than scaling single models within an architecture family. This is achieved by cascading ensemble members via an early-exit approach. In this work, we investigate extending these efficiency gains to tasks related to uncertainty estimation. As many such tasks, e.g. selective classification, are binary classification, our key novel insight is to only pass samples within a window close to the binary decision boundary to later cascade stages. Experiments on ImageNet-scale data across a number of network architectures and uncertainty tasks show that the proposed window-based early-exit approach is able to achieve a superior uncertainty-computation trade-off compared to scaling single models. For example, a cascaded EfficientNet-B2 ensemble is able to achieve similar coverage at 5% risk as a single EfficientNet-B4 with <30% the number of MACs. We also find that cascades/ensembles give more reliable improvements on OOD data vs scaling models up. Code for this work is available at: https://github.com/Guoxoug/window-early-exit.

Machine Learning models are being deployed as parts of real-world systems with the upsurge of interest in artificial intelligence. The design, implementation, and maintenance of such systems are challenged by real-world environments that produce larger amounts of heterogeneous data and users requiring increasingly faster responses with efficient resource consumption. These requirements push prevalent software architectures to the limit when deploying ML-based systems. Data-oriented Architecture (DOA) is an emerging concept that equips systems better for integrating ML models. DOA extends current architectures to create data-driven, loosely coupled, decentralised, open systems. Even though papers on deployed ML-based systems do not mention DOA, their authors made design decisions that implicitly follow DOA. The reasons why, how, and the extent to which DOA is adopted in these systems are unclear. Implicit design decisions limit the practitioners' knowledge of DOA to design ML-based systems in the real world. This paper answers these questions by surveying real-world deployments of ML-based systems. The survey shows the design decisions of the systems and the requirements these satisfy. Based on the survey findings, we also formulate practical advice to facilitate the deployment of ML-based systems. Finally, we outline open challenges to deploying DOA-based systems that integrate ML models.

Federated Learning (FL) is a machine learning paradigm that safeguards privacy by retaining client data on edge devices. However, optimizing FL in practice can be challenging due to the diverse and heterogeneous nature of the learning system. Though recent research has focused on improving the optimization of FL when distribution shifts occur among clients, ensuring global performance when multiple types of distribution shifts occur simultaneously among clients -- such as feature distribution shift, label distribution shift, and concept shift -- remain under-explored. In this paper, we identify the learning challenges posed by the simultaneous occurrence of diverse distribution shifts and propose a clustering principle to overcome these challenges. Through our research, we find that existing methods failed to address the clustering principle. Therefore, we propose a novel clustering algorithm framework, dubbed as FedRC, which adheres to our proposed clustering principle by incorporating a bi-level optimization problem and a novel objective function. Extensive experiments demonstrate that FedRC significantly outperforms other SOTA cluster-based FL methods. Our code will be publicly available.

Recently methods of graph neural networks (GNNs) have been applied to solving the problems in high energy physics (HEP) and have shown its great potential for quark-gluon tagging with graph representation of jet events. In this paper, we introduce an approach of GNNs combined with a HaarPooling operation to analyze the events, called HaarPooling Message Passing neural network (HMPNet). In HMPNet, HaarPooling not only extracts the features of graph, but embeds additional information obtained by clustering of k-means of different particle features. We construct Haarpooling from five different features: absolute energy $\log E$, transverse momentum $\log p_T$, relative coordinates $(\Delta\eta,\Delta\phi)$, the mixed ones $(\log E, \log p_T)$ and $(\log E, \log p_T, \Delta\eta,\Delta\phi)$. The results show that an appropriate selection of information for HaarPooling enhances the accuracy of quark-gluon tagging, as adding extra information of $\log P_T$ to the HMPNet outperforms all the others, whereas adding relative coordinates information $(\Delta\eta,\Delta\phi)$ is not very effective. This implies that by adding effective particle features from HaarPooling can achieve much better results than solely pure message passing neutral network (MPNN) can do, which demonstrates significant improvement of feature extraction via the pooling process. Finally we compare the HMPNet study, ordering by $p_T$, with other studies and prove that the HMPNet is also a good choice of GNN algorithms for jet tagging.

DBSCAN has been widely used in density-based clustering algorithms. However, with the increasing demand for Multi-density clustering, previous traditional DSBCAN can not have good clustering results on Multi-density datasets. In order to address this problem, an adaptive Multi-density DBSCAN algorithm (AMD-DBSCAN) is proposed in this paper. An improved parameter adaptation method is proposed in AMD-DBSCAN to search for multiple parameter pairs (i.e., Eps and MinPts), which are the key parameters to determine the clustering results and performance, therefore allowing the model to be applied to Multi-density datasets. Moreover, only one hyperparameter is required for AMD-DBSCAN to avoid the complicated repetitive initialization operations. Furthermore, the variance of the number of neighbors (VNN) is proposed to measure the difference in density between each cluster. The experimental results show that our AMD-DBSCAN reduces execution time by an average of 75% due to lower algorithm complexity compared with the traditional adaptive algorithm. In addition, AMD-DBSCAN improves accuracy by 24.7% on average over the state-of-the-art design on Multi-density datasets of extremely variable density, while having no performance loss in Single-density scenarios. Our code and datasets are available at https://github.com/AlexandreWANG915/AMD-DBSCAN.

Deep regression models typically learn in an end-to-end fashion without explicitly emphasizing a regression-aware representation. Consequently, the learned representations exhibit fragmentation and fail to capture the continuous nature of sample orders, inducing suboptimal results across a wide range of regression tasks. To fill the gap, we propose Rank-N-Contrast (RNC), a framework that learns continuous representations for regression by contrasting samples against each other based on their rankings in the target space. We demonstrate, theoretically and empirically, that RNC guarantees the desired order of learned representations in accordance with the target orders, enjoying not only better performance but also significantly improved robustness, efficiency, and generalization. Extensive experiments using five real-world regression datasets that span computer vision, human-computer interaction, and healthcare verify that RNC achieves state-of-the-art performance, highlighting its intriguing properties including better data efficiency, robustness to spurious targets and data corruptions, and generalization to distribution shifts. Code is available at: https://github.com/kaiwenzha/Rank-N-Contrast.