This study presents novel predictive models using Graph Neural Networks (GNNs) for simulating thermal dynamics in Laser Powder Bed Fusion (L-PBF) processes. By developing and validating Single-Laser GNN (SL-GNN) and Multi-Laser GNN (ML-GNN) surrogates, the research introduces a scalable data-driven approach that learns fundamental physics from small-scale Finite Element Analysis (FEA) simulations and applies them to larger domains. Achieving a Mean Absolute Percentage Error (MAPE) of 3.77% with the baseline SL-GNN model, GNNs effectively learn from high-resolution simulations and generalize well across larger geometries. The proposed models capture the complexity of the heat transfer process in L-PBF while significantly reducing computational costs. For example, a thermomechanical simulation for a 2 mm x 2 mm domain typically requires about 4 hours, whereas the SL-GNN model can predict thermal distributions almost instantly. Calibrating models to larger domains enhances predictive performance, with significant drops in MAPE for 3 mm x 3 mm and 4 mm x 4 mm domains, highlighting the scalability and efficiency of this approach. Additionally, models show a decreasing trend in Root Mean Square Error (RMSE) when tuned to larger domains, suggesting potential for becoming geometry-agnostic. The interaction of multiple lasers complicates heat transfer, necessitating larger model architectures and advanced feature engineering. Using hyperparameters from Gaussian process-based Bayesian optimization, the best ML-GNN model demonstrates a 46.4% improvement in MAPE over the baseline ML-GNN model. In summary, this approach enables more efficient and flexible predictive modeling in L-PBF additive manufacturing.

API call generation is the cornerstone of large language models' tool-using ability that provides access to the larger world. However, existing supervised and in-context learning approaches suffer from high training costs, poor data efficiency, and generated API calls that can be unfaithful to the API documentation and the user's request. To address these limitations, we propose an output-side optimization approach called FANTASE. Two of the unique contributions of FANTASE are its State-Tracked Constrained Decoding (SCD) and Reranking components. SCD dynamically incorporates appropriate API constraints in the form of Token Search Trie for efficient and guaranteed generation faithfulness with respect to the API documentation. The Reranking component efficiently brings in the supervised signal by leveraging a lightweight model as the discriminator to rerank the beam-searched candidate generations of the large language model. We demonstrate the superior performance of FANTASE in API call generation accuracy, inference efficiency, and context efficiency with DSTC8 and API Bank datasets.

As Artificial Intelligence (AI) increasingly integrates into our daily lives, fairness has emerged as a critical concern, particularly in medical AI, where datasets often reflect inherent biases due to social factors like the underrepresentation of marginalized communities and socioeconomic barriers to data collection. Traditional approaches to mitigating these biases have focused on data augmentation and the development of fairness-aware training algorithms. However, this paper argues that the architecture of neural networks, a core component of Machine Learning (ML), plays a crucial role in ensuring fairness. We demonstrate that addressing fairness effectively requires a holistic approach that simultaneously considers data, algorithms, and architecture. Utilizing Automated ML (AutoML) technology, specifically Neural Architecture Search (NAS), we introduce a novel framework, BiaslessNAS, designed to achieve fair outcomes in analyzing skin lesion datasets. BiaslessNAS incorporates fairness considerations at every stage of the NAS process, leading to the identification of neural networks that are not only more accurate but also significantly fairer. Our experiments show that BiaslessNAS achieves a 2.55% increase in accuracy and a 65.50% improvement in fairness compared to traditional NAS methods, underscoring the importance of integrating fairness into neural network architecture for better outcomes in medical AI applications.

This paper presents the contribution of our dzNLP team to the NADI 2024 shared task, specifically in Subtask 1 - Multi-label Country-level Dialect Identification (MLDID) (Closed Track). We explored various configurations to address the challenge: in Experiment 1, we utilized a union of n-gram analyzers (word, character, character with word boundaries) with different n-gram values; in Experiment 2, we combined a weighted union of Term Frequency-Inverse Document Frequency (TF-IDF) features with various weights; and in Experiment 3, we implemented a weighted major voting scheme using three classifiers: Linear Support Vector Classifier (LSVC), Random Forest (RF), and K-Nearest Neighbors (KNN). Our approach, despite its simplicity and reliance on traditional machine learning techniques, demonstrated competitive performance in terms of F1-score and precision. Notably, we achieved the highest precision score of 63.22% among the participating teams. However, our overall F1 score was approximately 21%, significantly impacted by a low recall rate of 12.87%. This indicates that while our models were highly precise, they struggled to recall a broad range of dialect labels, highlighting a critical area for improvement in handling diverse dialectal variations.

Foundation models and vision-language pre-training have notably advanced Vision Language Models (VLMs), enabling multimodal processing of visual and linguistic data. However, their performance has been typically assessed on general scene understanding - recognizing objects, attributes, and actions - rather than cultural comprehension. This study introduces CulturalVQA, a visual question-answering benchmark aimed at assessing VLM's geo-diverse cultural understanding. We curate a collection of 2,378 image-question pairs with 1-5 answers per question representing cultures from 11 countries across 5 continents. The questions probe understanding of various facets of culture such as clothing, food, drinks, rituals, and traditions. Benchmarking VLMs on CulturalVQA, including GPT-4V and Gemini, reveals disparity in their level of cultural understanding across regions, with strong cultural understanding capabilities for North America while significantly lower performance for Africa. We observe disparity in their performance across cultural facets too, with clothing, rituals, and traditions seeing higher performances than food and drink. These disparities help us identify areas where VLMs lack cultural understanding and demonstrate the potential of CulturalVQA as a comprehensive evaluation set for gauging VLM progress in understanding diverse cultures.

Direct Preference Optimization (DPO) has become a widely used training method for the instruction fine-tuning of large language models (LLMs). In this work, we explore an under-investigated aspect of DPO - its dependency on the reference model or policy. Such reference policies, typically instantiated as the model to be further fine-tuned, are important since they can impose an upper limit on DPO's effectiveness. Therefore, we address three related research questions in this work. First, we explore the optimal strength of the KL-divergence constraint in DPO, which penalizes deviations from the reference policy, and find that DPO is sensitive to this strength. Next, we examine the necessity of reference policies for instruction fine-tuning by providing both theoretical and empirical comparisons between DPO and related learning objectives, demonstrating DPO's superiority. Additionally, we investigate whether DPO benefits from stronger reference policies, finding that a stronger reference policy can lead to improved performance, but only when it is similar to the model being fine-tuned. Our findings highlight the confounding role of reference policies in DPO and offer insights for best practices, while also identifying open research questions for future studies.

Measurement and analysis of high energetic particles for scientific, medical or industrial applications is a complex procedure, requiring the design of sophisticated detector and data processing systems. The development of adaptive and differentiable software pipelines using a combination of conventional and machine learning algorithms is therefore getting ever more important to optimize and operate the system efficiently while maintaining end-to-end (E2E) differentiability. We propose for the application of charged particle tracking an E2E differentiable decision-focused learning scheme using graph neural networks with combinatorial components solving a linear assignment problem for each detector layer. We demonstrate empirically that including differentiable variations of discrete assignment operations allows for efficient network optimization, working better or on par with approaches that lack E2E differentiability. In additional studies, we dive deeper into the optimization process and provide further insights from a loss landscape perspective. We demonstrate that while both methods converge into similar performing, globally well-connected regions, they suffer under substantial predictive instability across initialization and optimization methods, which can have unpredictable consequences on the performance of downstream tasks such as image reconstruction. We also point out a dependency between the interpolation factor of the gradient estimator and the prediction stability of the model, suggesting the choice of sufficiently small values. Given the strong global connectivity of learned solutions and the excellent training performance, we argue that E2E differentiability provides, besides the general availability of gradient information, an important tool for robust particle tracking to mitigate prediction instabilities by favoring solutions that perform well on downstream tasks.

This article proposes two new algorithms tailored to discrete-time deterministic finite-horizon nonlinear optimal control problems or so-called trajectory optimization problems. Both algorithms are inspired by a novel theoretical paradigm known as probabilistic optimal control, that reformulates optimal control as an equivalent probabilistic inference problem. This perspective allows to address the problem using the Expectation-Maximization algorithm. We show that the application of this algorithm results in a fixed point iteration of probabilistic policies that converge to the deterministic optimal policy. Two strategies for policy evaluation are discussed, using state-of-the-art uncertainty quantification methods resulting into two distinct algorithms. The algorithms are structurally closest related to the differential dynamic programming algorithm and related methods that use sigma-point methods to avoid direct gradient evaluations. The main advantage of our work is an improved balance between exploration and exploitation over the iterations, leading to improved numerical stability and accelerated convergence. These properties are demonstrated on different nonlinear systems.

Current multimodal machine translation (MMT) systems rely on fully supervised data (i.e models are trained on sentences with their translations and accompanying images). However, this type of data is costly to collect, limiting the extension of MMT to other language pairs for which such data does not exist. In this work, we propose a method to bypass the need for fully supervised data to train MMT systems, using multimodal English data only. Our method, called ZeroMMT, consists in adapting a strong text-only machine translation (MT) model by training it on a mixture of two objectives: visually conditioned masked language modelling and the Kullback-Leibler divergence between the original and new MMT outputs. We evaluate on standard MMT benchmarks and the recently released CoMMuTE, a contrastive benchmark aiming to evaluate how well models use images to disambiguate English sentences. We obtain disambiguation performance close to state-of-the-art MMT models trained additionally on fully supervised examples. To prove that our method generalizes to languages with no fully supervised training data available, we extend the CoMMuTE evaluation dataset to three new languages: Arabic, Russian and Chinese. We further show that we can control the trade-off between disambiguation capabilities and translation fidelity at inference time using classifier-free guidance and without any additional data. Our code, data and trained models are publicly accessible.

When large language models (LLMs) exceed human-level capabilities, it becomes increasingly challenging to provide full-scale and accurate supervisions for these models. Weak-to-strong learning, which leverages a less capable model to unlock the latent abilities of a stronger model, proves valuable in this context. Yet, the efficacy of this approach for complex reasoning tasks is still untested. Furthermore, tackling reasoning tasks under the weak-to-strong setting currently lacks efficient methods to avoid blindly imitating the weak supervisor including its errors. In this paper, we introduce a progressive learning framework that enables the strong model to autonomously refine its training data, without requiring input from either a more advanced model or human-annotated data. This framework begins with supervised fine-tuning on a selective small but high-quality dataset, followed by preference optimization on contrastive samples identified by the strong model itself. Extensive experiments on the GSM8K and MATH datasets demonstrate that our method significantly enhances the reasoning capabilities of Llama2-70b using three separate weak models. This method is further validated in a forward-looking experimental setup, where Llama3-8b-instruct effectively supervises Llama3-70b on the highly challenging OlympicArena dataset. This work paves the way for a more scalable and sophisticated strategy to enhance AI reasoning powers.