In the last ten years, various automated machine learning (AutoM ) systems have been proposed to build end-to-end machine learning (ML) pipelines with minimal human interaction. Even though such automatically synthesized ML pipelines are able to achieve a competitive performance, recent studies have shown that users do not trust models constructed by AutoML due to missing transparency of AutoML systems and missing explanations for the constructed ML pipelines. In a requirements analysis study with 36 domain experts, data scientists, and AutoML researchers from different professions with vastly different expertise in ML, we collect detailed informational needs for AutoML. We propose XAutoML, an interactive visual analytics tool for explaining arbitrary AutoML optimization procedures and ML pipelines constructed by AutoML. XAutoML combines interactive visualizations with established techniques from explainable artificial intelligence (XAI) to make the complete AutoML procedure transparent and explainable. By integrating XAutoML with JupyterLab, experienced users can extend the visual analytics with ad-hoc visualizations based on information extracted from XAutoML. We validate our approach in a user study with the same diverse user group from the requirements analysis. All participants were able to extract useful information from XAutoML, leading to a significantly increased understanding of ML pipelines produced by AutoML and the AutoML optimization itself.

In this study, we propose a novel multi-objective Bayesian optimization (MOBO) method to efficiently identify the Pareto front (PF) defined by risk measures for black-box functions under the presence of input uncertainty (IU). Existing BO methods for Pareto optimization in the presence of IU are risk-specific or without theoretical guarantees, whereas our proposed method addresses general risk measures and has theoretical guarantees. The basic idea of the proposed method is to assume a Gaussian process (GP) model for the black-box function and to construct high-probability bounding boxes for the risk measures using the GP model. Furthermore, in order to reduce the uncertainty of non-dominated bounding boxes, we propose a method of selecting the next evaluation point using a maximin distance defined by the maximum value of a quasi distance based on bounding boxes. As theoretical analysis, we prove that the algorithm can return an arbitrary-accurate solution in a finite number of iterations with high probability, for various risk measures such as Bayes risk, worst-case risk, and value-at-risk. We also give a theoretical analysis that takes into account approximation errors because there exist non-negligible approximation errors (e.g., finite approximation of PFs and sampling-based approximation of bounding boxes) in practice. We confirm that the proposed method outperforms compared with existing methods not only in the setting with IU but also in the setting of ordinary MOBO through numerical experiments.

Optimal Transport has received much attention in Machine Learning as it allows to compare probability distributions by exploiting the geometry of the underlying space. However, in its original formulation, solving this problem suffers from a significant computational burden. Thus, a meaningful line of work consists at proposing alternatives to reduce this burden while still enjoying its properties. In this thesis, we focus on alternatives which use projections on subspaces. The main such alternative is the Sliced-Wasserstein distance, which we first propose to extend to Riemannian manifolds in order to use it in Machine Learning applications for which using such spaces has been shown to be beneficial in the recent years. We also study sliced distances between positive measures in the so-called unbalanced OT problem. Back to the original Euclidean Sliced-Wasserstein distance between probability measures, we study the dynamic of gradient flows when endowing the space with this distance in place of the usual Wasserstein distance. Then, we investigate the use of the Busemann function, a generalization of the inner product in metric spaces, in the space of probability measures. Finally, we extend the subspace detour approach to incomparable spaces using the Gromov-Wasserstein distance.

This study focuses on the optimization of the Big-means algorithm for clustering large-scale datasets, exploring four distinct parallelization strategies. We conducted extensive experiments to assess the computational efficiency, scalability, and clustering performance of each approach, revealing their benefits and limitations. The paper also delves into the trade-offs between computational efficiency and clustering quality, examining the impacts of various factors. Our insights provide practical guidance on selecting the best parallelization strategy based on available resources and dataset characteristics, contributing to a deeper understanding of parallelization techniques for the Big-means algorithm.

Federated learning (FL) is a popular privacy-preserving distributed training scheme, where multiple devices collaborate to train machine learning models by uploading local model updates. To improve communication efficiency, over-the-air computation (AirComp) has been applied to FL, which leverages analog modulation to harness the superposition property of radio waves such that numerous devices can upload their model updates concurrently for aggregation. However, the uplink channel noise incurs considerable model aggregation distortion, which is critically determined by the device scheduling and compromises the learned model performance. In this paper, we propose a probabilistic device scheduling framework for over-the-air FL, named PO-FL, to mitigate the negative impact of channel noise, where each device is scheduled according to a certain probability and its model update is reweighted using this probability in aggregation. We prove the unbiasedness of this aggregation scheme and demonstrate the convergence of PO-FL on both convex and non-convex loss functions. Our convergence bounds unveil that the device scheduling affects the learning performance through the communication distortion and global update variance. Based on the convergence analysis, we further develop a channel and gradient-importance aware algorithm to optimize the device scheduling probabilities in PO-FL. Extensive simulation results show that the proposed PO-FL framework with channel and gradient-importance awareness achieves faster convergence and produces better models than baseline methods.

We introduce a novel image-to-painting method that facilitates the creation of large-scale, high-fidelity paintings with human-like quality and stylistic variation. To process large images and gain control over the painting process, we introduce a segmentation-based painting process and a dynamic attention map approach inspired by human painting strategies, allowing optimization of brush strokes to proceed in batches over different image regions, thereby capturing both large-scale structure and fine details, while also allowing stylistic control over detail. Our optimized batch processing and patch-based loss framework enable efficient handling of large canvases, ensuring our painted outputs are both aesthetically compelling and functionally superior as compared to previous methods, as confirmed by rigorous evaluations. Code available at: https://github.com/manuelladron/semantic\_based\_painting.git

Optimization problems find widespread use in both single-objective and multiobjective scenarios. In practical applications, users aspire for solutions that converge to the region of interest (ROI) along the Pareto front (PF). While the conventional approach involves approximating a fitness function or an objective function to reflect user preferences, this paper explores an alternative avenue. Specifically, we aim to discover a method that sidesteps the need for calculating the fitness function, relying solely on human feedback. Our proposed approach entails conducting direct preference learning facilitated by an active dueling bandit algorithm. The experimental phase is structured into three sessions. Firstly, we assess the performance of our active dueling bandit algorithm. Secondly, we implement our proposed method within the context of Multi-objective Evolutionary Algorithms (MOEAs). This research presents a novel interactive preference-based MOEA framework that not only addresses the limitations of traditional techniques but also unveils new possibilities for optimization problems. In optimization problems, algorithms typically converge to the Pareto front (PF), yet users aim for convergence in their specific region of interest (ROI).

In industrial settings, many software determine the optimal power production from each generators tools consistently employ DCOPF for simulating, analyzing, within the power grid in order to meet the demand and forecasting Locational Marginal Price (LMP) [3] of electricity consumption, meanwhile satisfying physical However, with the increasing penetration of renewable and engineering constraints. As a crucial aspect in energy energy sources (RES), such as wind and solar power generators, management, OPF has been defined since 1962 and has solving the OPF problem becomes more significant many variants in the process of development according to and frequent. The uncertain nature of large-scale integration different formulations and constraints it contains [1]. of variable RES makes it technically challenging to keep One of the variants that use exact alternating current the power system flexible [4, 5]. Flexibility maintenance in formulation is known as ACOPF. In addition to determining power systems requires providing supply-demand balance, the active and reactive power output from generators, maintaining continuity in unexpected situations, and coping other control variables in the power grid such as voltage with uncertainty on supply-demand sides [6], which is one magnitude and voltage angle are also determined subject to of the main objects in OPF problem. Solar power is determined their constraints. Due to the sinusoidal nature of alternating by solar irradiation and wind power is determined current, the optimization problem becomes nonlinear and by the wind speed, i.e., the meteorological condition, which non-convex. Consequently, ACOPF has been demonstrated changes in very short time intervals especially for wind.

Combinatorial optimization finds an optimal solution within a discrete set of variables and constraints. The field has seen tremendous progress both in research and industry. With the success of deep learning in the past decade, a recent trend in combinatorial optimization has been to improve state-of-the-art combinatorial optimization solvers by replacing key heuristic components with machine learning (ML) models. In this paper, we investigate two essential aspects of machine learning algorithms for combinatorial optimization: temporal characteristics and attention. We argue that for the task of variable selection in the branch-and-bound (B&B) algorithm, incorporating the temporal information as well as the bipartite graph attention improves the solver's performance. We support our claims with intuitions and numerical results over several standard datasets used in the literature and competitions. Code is available at: https://developer.huaweicloud.com/develop/aigallery/notebook/detail?id=047c6cf2-8463-40d7-b92f-7b2ca998e935

This paper studies the scheduling of autonomous mobile robots (AMRs) at hospitals where the stochastic travel times and service times of AMRs are affected by the surrounding environment. The routes of AMRs are planned to minimize the daily cost of the hospital (including the AMR fixed cost, penalty cost of violating the time window, and transportation cost). To efficiently generate high-quality solutions, some properties are identified and incorporated into an improved tabu search (I-TS) algorithm for problem-solving. Experimental evaluations demonstrate that the I-TS algorithm outperforms existing methods by producing high-quality solutions. Based on the characteristics of healthcare requests and the AMR working environment, scheduling AMRs reasonably can effectively provide medical services, improve the utilization of medical resources, and reduce hospital costs.