Training on large-scale graphs has achieved remarkable results in graph representation learning, but its cost and storage have attracted increasing concerns.

Restricted kernel machines (RKMs) have demonstrated a significant impact in enhancing generalization ability in the field of machine learning. Recent studies have introduced various methods within the RKM framework, combining kernel functions with the least squares support vector machine (LSSVM) in a manner similar to the energy function of restricted boltzmann machines (RBM), such that a better performance can be achieved. However, RKM's efficacy can be compromised by the presence of outliers and other forms of contamination within the dataset. These anomalies can skew the learning process, leading to less accurate and reliable outcomes. To address this critical issue and to ensure the robustness of the model, we propose the novel one-class RKM (OCRKM). In the framework of OCRKM, we employ an energy function akin to that of the RBM, which integrates both visible and hidden variables in a nonprobabilistic setting. The formulation of the proposed OCRKM facilitates the seamless integration of one-class classification method with the RKM, enhancing its capability to detect outliers and anomalies effectively. The proposed OCRKM model is evaluated over UCI benchmark datasets. Experimental findings and statistical analyses consistently emphasize the superior generalization capabilities of the proposed OCRKM model over baseline models across all scenarios.

Quantification, or prevalence estimation, is the task of predicting the prevalence of each class within an unknown bag of examples. Most existing quantification methods in the literature rely on prior probability shift assumptions to create a quantification model that uses the predictions of an underlying classifier to make optimal prevalence estimates. In this work, we present an end-to-end neural network that uses Gaussian distributions in latent spaces to obtain invariant representations of bags of examples. This approach addresses the quantification problem using deep learning, enabling the optimization of specific loss functions relevant to the problem and avoiding the need for an intermediate classifier, tackling the quantification problem as a direct optimization problem. Our method achieves state-of-the-art results, both against traditional quantification methods and other deep learning approaches for quantification. The code needed to reproduce all our experiments is publicly available at https://github.com/AICGijon/gmnet.

Measures of voting power have been the subject of extensive research since the mid 1940s. More recently, similar measures of relative importance have been studied in other domains that include inconsistent knowledge bases, intensity of attacks in argumentation, different problems in the analysis of database management, and explainability. This paper demonstrates that all these examples are instantiations of computing measures of importance for a rather more general problem domain. The paper then shows that the best-known measures of importance can be computed for any reference set whenever one is given a monotonically increasing predicate that partitions the subsets of that reference set. As a consequence, the paper also proves that measures of importance can be devised in several domains, for some of which such measures have not yet been studied nor proposed. Furthermore, the paper highlights several research directions related with computing measures of importance.

In this paper we present a hybrid method for the automatic detection of dermatological pathologies in medical reports. We use a large language model combined with medical ontologies to predict, given a first appointment or follow-up medical report, the pathology a person may suffer from. The results show that teaching the model to learn the type, severity and location on the body of a dermatological pathology as well as in which order it has to learn these three features significantly increases its accuracy. The article presents the demonstration of state-of-the-art results for classification of medical texts with a precision of 0.84, micro and macro F1-score of 0.82 and 0.75, and makes both the method and the dataset used available to the community.

High-precision surface defect detection in manufacturing is essential for ensuring quality control. Laser triangulation profilometric sensors are key to this process, providing detailed and accurate surface measurements over a line. To achieve a complete and precise surface scan, accurate relative motion between the sensor and the workpiece is required. It is crucial to control the sensor pose to maintain optimal distance and relative orientation to the surface. It is also important to ensure uniform profile distribution throughout the scanning process. This paper presents a novel Reinforcement Learning (RL) based approach to optimize robot inspection trajectories for profilometric sensors. Building upon the Boustrophedon scanning method, our technique dynamically adjusts the sensor position and tilt to maintain optimal orientation and distance from the surface, while also ensuring a consistent profile distance for uniform and high-quality scanning. Utilizing a simulated environment based on the CAD model of the part, we replicate real-world scanning conditions, including sensor noise and surface irregularities. This simulation-based approach enables offline trajectory planning based on CAD models. Key contributions include the modeling of the state space, action space, and reward function, specifically designed for inspection applications using profilometric sensors. We use Proximal Policy Optimization (PPO) algorithm to efficiently train the RL agent, demonstrating its capability to optimize inspection trajectories with profilometric sensors. To validate our approach, we conducted several experiments where a model trained on a specific training piece was tested on various parts in simulation. Also, we conducted a real-world experiment by executing the optimized trajectory, generated offline from a CAD model, to inspect a part using a UR3e robotic arm model.

Existing sample-based methods, like influence functions and representer points, measure the importance of a training point by approximating the effect of its removal from training. As such, they are skewed towards outliers and points that are very close to the decision boundaries. The explanations provided by these methods are often static and not specific enough for different test points. In this paper, we propose a method to generate an explanation in the form of support spectrums which are based on two main ideas: the support sets and a global-to-local importance measure. The support set is the set of training points, in the predicted class, that ``lie in between'' the test point and training points in the other classes. They indicate how well the test point can be distinguished from the points not in the predicted class. The global-to-local importance measure is obtained by decoupling existing methods into the global and local components which are then used to select the points in the support set. Using this method, we are able to generate explanations that are tailored to specific test points. In the experiments, we show the effectiveness of the method in image classification and text generation tasks.

The vast majority of materials science knowledge exists in unstructured natural language, yet structured data is crucial for innovative and systematic materials design. Traditionally, the field has relied on manual curation and partial automation for data extraction for specific use cases. The advent of large language models (LLMs) represents a significant shift, potentially enabling efficient extraction of structured, actionable data from unstructured text by non-experts. While applying LLMs to materials science data extraction presents unique challenges, domain knowledge offers opportunities to guide and validate LLM outputs. This review provides a comprehensive overview of LLM-based structured data extraction in materials science, synthesizing current knowledge and outlining future directions. We address the lack of standardized guidelines and present frameworks for leveraging the synergy between LLMs and materials science expertise. This work serves as a foundational resource for researchers aiming to harness LLMs for data-driven materials research. The insights presented here could significantly enhance how researchers across disciplines access and utilize scientific information, potentially accelerating the development of novel materials for critical societal needs.

Countless domains rely on Machine Learning (ML) models, including safety-critical domains, such as autonomous driving, which this paper focuses on. While the black box nature of ML is simply a nuisance in some domains, in safety-critical domains, this makes ML models difficult to trust. To fully utilize ML models in safety-critical domains, it would be beneficial to have a method to improve trust in model robustness and accuracy without human experts checking each decision. This research proposes a method to increase trust in ML models used in safety-critical domains by ensuring the robustness and completeness of the model's training dataset. Because ML models embody what they are trained with, ensuring the completeness of training datasets can help to increase the trust in the training of ML models. To this end, this paper proposes the use of a domain ontology and an image quality characteristic ontology to validate the domain completeness and image quality robustness of a training dataset. This research also presents an experiment as a proof of concept for this method, where ontologies are built for the emergency road vehicle domain.