Related papers: Atlas: A Framework for ML Lifecycle Provenance & T…

As Large Language Models (LLMs) become integral to scientific workflows, concerns over the confidentiality and ethical handling of confidential data have emerged. This paper explores data exposure risks through LLM-powered scientific tools,…

The prevailing methodologies for visualizing AI risks have focused on technical issues such as data biases and model inaccuracies, often overlooking broader societal risks like job loss and surveillance. Moreover, these visualizations are…

ML/AI is the field of computer science and computer engineering that arguably received the most attention and funding over the last decade. Data is the key element of ML/AI, so it is becoming increasingly important to ensure that users are…

Modern Large Language Model (LLM) systems are assembled from third-party artifacts such as pre-trained weights, fine-tuning adapters, datasets, dependency packages, and container images, fetched through automated pipelines. This speed comes…

While Machine Learning (ML) technologies are widely adopted in many mission critical fields to support intelligent decision-making, concerns remain about system resilience against ML-specific security attacks and privacy breaches as well as…

Machine Learning (ML) is now used in a range of systems with results that are reported to exceed, under certain conditions, human performance. Many of these systems, in domains such as healthcare , automotive and manufacturing, exhibit high…

Machine Learning (ML) has already fundamentally changed several businesses. More recently, it has also been profoundly impacting the computational science and engineering domains, like geoscience, climate science, and health science. In…

Machine learning (ML) has the potential to revolutionize a wide range of research areas and industries, but many ML projects never progress past the proof-of-concept stage. To address this issue, we introduce Model Share AI (AIMS), an…

In the past decade, Artificial Intelligence (AI) has become a part of our daily lives due to major advances in Machine Learning (ML) techniques. In spite of an explosive growth in the raw AI technology and in consumer facing applications on…

Tool-integrated LLMs can retrieve, compute, and take real-world actions via external tools, but reliability remains a key bottleneck. We argue that failures stem from both tool-use accuracy (how well an agent invokes a tool) and intrinsic…

ATLAS is a constraint-guided generation framework for structured engineering artifacts whose outputs must satisfy explicit schemas, domain rules, and audit requirements. Rather than treating a large language model as a standalone generator,…

One of the key requirements for incorporating machine learning into the drug discovery process is complete reproducibility and traceability of the model building and evaluation process. With this in mind, we have developed an end-to-end…

Machine learning (ML) is increasingly applied across industries to automate decision-making, but concerns about ethical and legal compliance remain due to limited transparency, fairness, and accountability. Monitoring through logging a…

We present the Explabox: an open-source toolkit for transparent and responsible machine learning (ML) model development and usage. Explabox aids in achieving explainable, fair and robust models by employing a four-step strategy: explore,…

Machine learning (ML) has become a core component of many real-world applications and training data is a key factor that drives current progress. This huge success has led Internet companies to deploy machine learning as a service (MLaaS).…

We present the Open MatSci ML Toolkit: a flexible, self-contained, and scalable Python-based framework to apply deep learning models and methods on scientific data with a specific focus on materials science and the OpenCatalyst Dataset. Our…

Machine learning (ML) systems are vulnerable to performance decline over time due to dataset shift. To address this problem, experts often suggest that ML systems should be regularly updated to ensure ongoing performance stability. Some…

As AI agents move from demos into enterprise deployments, their failure modes become consequential: a misinterpreted tool argument can corrupt production data, a silent reasoning error can go undetected until damage is done, and outputs…

Over the past few decades, Industrial Control Systems (ICSs) have been targeted by cyberattacks and are becoming increasingly vulnerable as more ICSs are connected to the internet. Using Machine Learning (ML) for Intrusion Detection Systems…

Automated Machine Learning (AutoML) is used more than ever before to support users in determining efficient hyperparameters, neural architectures, or even full machine learning pipelines. However, users tend to mistrust the optimization…