In this paper, we show how mixed-integer conic optimization can be used to combine feature subset selection with holistic generalized linear models to fully automate the model selection process. Concretely, we directly optimize for the Akaike and Bayesian information criteria while imposing constraints designed to deal with multicollinearity in the feature selection task. Specifically, we propose a novel pairwise correlation constraint that combines the sign coherence constraint with ideas from classical statistical models like Ridge regression and the OSCAR model.

The success of contrastive language-image pretraining (CLIP) relies on the supervision from the pairing between images and captions, which tends to be noisy in web-crawled data. We present Mixture of Data Experts (MoDE) and learn a system of CLIP data experts via clustering. Each data expert is trained on one data cluster, being less sensitive to false negative noises in other clusters. At inference time, we ensemble their outputs by applying weights determined through the correlation between task metadata and cluster conditions. To estimate the correlation precisely, the samples in one cluster should be semantically similar, but the number of data experts should still be reasonable for training and inference. As such, we consider the ontology in human language and propose to use fine-grained cluster centers to represent each data expert at a coarse-grained level. Experimental studies show that four CLIP data experts on ViT-B/16 outperform the ViT-L/14 by OpenAI CLIP and OpenCLIP on zero-shot image classification but with less ($<$35\%) training cost. Meanwhile, MoDE can train all data expert asynchronously and can flexibly include new data experts. The code is available at https://github.com/facebookresearch/MetaCLIP/tree/main/mode.

The global decline in bee populations poses significant risks to agriculture, biodiversity, and environmental stability. To bridge the gap in existing data, we introduce ApisTox, a comprehensive dataset focusing on the toxicity of pesticides to honey bees (Apis mellifera). This dataset combines and leverages data from existing sources such as ECOTOX and PPDB, providing an extensive, consistent, and curated collection that surpasses the previous datasets. ApisTox incorporates a wide array of data, including toxicity levels for chemicals, details such as time of their publication in literature, and identifiers linking them to external chemical databases. This dataset may serve as an important tool for environmental and agricultural research, but also can support the development of policies and practices aimed at minimizing harm to bee populations. Finally, ApisTox offers a unique resource for benchmarking molecular property prediction methods on agrochemical compounds, facilitating advancements in both environmental science and cheminformatics. This makes it a valuable tool for both academic research and practical applications in bee conservation.

LiDAR-based 3D object detection has become an essential part of automated driving due to its ability to localize and classify objects precisely in 3D. However, object detectors face a critical challenge when dealing with unknown foreground objects, particularly those that were not present in their original training data. These out-of-distribution (OOD) objects can lead to misclassifications, posing a significant risk to the safety and reliability of automated vehicles. Currently, LiDAR-based OOD object detection has not been well studied. We address this problem by generating synthetic training data for OOD objects by perturbing known object categories. Our idea is that these synthetic OOD objects produce different responses in the feature map of an object detector compared to in-distribution (ID) objects. We then extract features using a pre-trained and fixed object detector and train a simple multilayer perceptron (MLP) to classify each detection as either ID or OOD. In addition, we propose a new evaluation protocol that allows the use of existing datasets without modifying the point cloud, ensuring a more authentic evaluation of real-world scenarios. The effectiveness of our method is validated through experiments on the newly proposed nuScenes OOD benchmark. The source code is available at https://github.com/uulm-mrm/mmood3d.

Accelerating cavities are an integral part of the Continuous Electron Beam Accelerator Facility (CEBAF) at Jefferson Laboratory. When any of the over 400 cavities in CEBAF experiences a fault, it disrupts beam delivery to experimental user halls. In this study, we propose the use of a deep learning model to predict slowly developing cavity faults. By utilizing pre-fault signals, we train a LSTM-CNN binary classifier to distinguish between radio-frequency (RF) signals during normal operation and RF signals indicative of impending faults. We optimize the model by adjusting the fault confidence threshold and implementing a multiple consecutive window criterion to identify fault events, ensuring a low false positive rate. Results obtained from analysis of a real dataset collected from the accelerating cavities simulating a deployed scenario demonstrate the model's ability to identify normal signals with 99.99% accuracy and correctly predict 80% of slowly developing faults. Notably, these achievements were achieved in the context of a highly imbalanced dataset, and fault predictions were made several hundred milliseconds before the onset of the fault. Anticipating faults enables preemptive measures to improve operational efficiency by preventing or mitigating their occurrence.

With the growing demand for synthetic data to address contemporary issues in machine learning, such as data scarcity, data fairness, and data privacy, having robust tools for assessing the utility and potential privacy risks of such data becomes crucial. SynthEval, a novel open-source evaluation framework distinguishes itself from existing tools by treating categorical and numerical attributes with equal care, without assuming any special kind of preprocessing steps. This~makes it applicable to virtually any synthetic dataset of tabular records. Our tool leverages statistical and machine learning techniques to comprehensively evaluate synthetic data fidelity and privacy-preserving integrity. SynthEval integrates a wide selection of metrics that can be used independently or in highly customisable benchmark configurations, and can easily be extended with additional metrics. In this paper, we describe SynthEval and illustrate its versatility with examples. The framework facilitates better benchmarking and more consistent comparisons of model capabilities.

Although fusion of information from multiple views of mammograms plays an important role to increase accuracy of breast cancer detection, developing multi-view mammograms-based computer-aided diagnosis (CAD) schemes still faces challenges and no such CAD schemes have been used in clinical practice. To overcome the challenges, we investigate a new approach based on Contrastive Language-Image Pre-training (CLIP), which has sparked interest across various medical imaging tasks. By solving the challenges in (1) effectively adapting the single-view CLIP for multi-view feature fusion and (2) efficiently fine-tuning this parameter-dense model with limited samples and computational resources, we introduce Mammo-CLIP, the first multi-modal framework to process multi-view mammograms and corresponding simple texts. Mammo-CLIP uses an early feature fusion strategy to learn multi-view relationships in four mammograms acquired from the CC and MLO views of the left and right breasts. To enhance learning efficiency, plug-and-play adapters are added into CLIP image and text encoders for fine-tuning parameters and limiting updates to about 1% of the parameters. For framework evaluation, we assembled two datasets retrospectively. The first dataset, comprising 470 malignant and 479 benign cases, was used for few-shot fine-tuning and internal evaluation of the proposed Mammo-CLIP via 5-fold cross-validation. The second dataset, including 60 malignant and 294 benign cases, was used to test generalizability of Mammo-CLIP. Study results show that Mammo-CLIP outperforms the state-of-art cross-view transformer in AUC (0.841 vs. 0.817, 0.837 vs. 0.807) on both datasets. It also surpasses previous two CLIP-based methods by 20.3% and 14.3%. This study highlights the potential of applying the finetuned vision-language models for developing next-generation, image-text-based CAD schemes of breast cancer.

Earthquake-induced liquefaction can cause substantial lateral spreading, posing threats to infrastructure. Machine learning (ML) can improve lateral spreading prediction models by capturing complex soil characteristics and site conditions. However, the "black box" nature of ML models can hinder their adoption in critical decision-making. This study addresses this limitation by using SHapley Additive exPlanations (SHAP) to interpret an eXtreme Gradient Boosting (XGB) model for lateral spreading prediction, trained on data from the 2011 Christchurch Earthquake. SHAP analysis reveals the factors driving the model's predictions, enhancing transparency and allowing for comparison with established engineering knowledge. The results demonstrate that the XGB model successfully identifies the importance of soil characteristics derived from Cone Penetration Test (CPT) data in predicting lateral spreading, validating its alignment with domain understanding. This work highlights the value of explainable machine learning for reliable and informed decision-making in geotechnical engineering and hazard assessment.

The right to be forgotten (RTBF) seeks to safeguard individuals from the enduring effects of their historical actions by implementing machine-learning techniques. These techniques facilitate the deletion of previously acquired knowledge without requiring extensive model retraining. However, they often overlook a critical issue: unlearning processes bias. This bias emerges from two main sources: (1) data-level bias, characterized by uneven data removal, and (2) algorithm-level bias, which leads to the contamination of the remaining dataset, thereby degrading model accuracy. In this work, we analyze the causal factors behind the unlearning process and mitigate biases at both data and algorithmic levels. Typically, we introduce an intervention-based approach, where knowledge to forget is erased with a debiased dataset. Besides, we guide the forgetting procedure by leveraging counterfactual examples, as they maintain semantic data consistency without hurting performance on the remaining dataset. Experimental results demonstrate that our method outperforms existing machine unlearning baselines on evaluation metrics.

We present a machine learning-based anomaly detection product, AI Detect and Respond (AIDR), that monitors Walmart's business and system health in real-time. During the validation over 3 months, the product served predictions from over 3000 models to more than 25 application, platform, and operation teams, covering 63\% of major incidents and reducing the mean-time-to-detect (MTTD) by more than 7 minutes. Unlike previous anomaly detection methods, our solution leverages statistical, ML and deep learning models while continuing to incorporate rule-based static thresholds to incorporate domain-specific knowledge. Both univariate and multivariate ML models are deployed and maintained through distributed services for scalability and high availability. AIDR has a feedback loop that assesses model quality with a combination of drift detection algorithms and customer feedback. It also offers self-onboarding capabilities and customizability. AIDR has achieved success with various internal teams with lower time to detection and fewer false positives than previous methods. As we move forward, we aim to expand incident coverage and prevention, reduce noise, and integrate further with root cause recommendation (RCR) to enable an end-to-end AIDR experience.