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Identifying Flaky Tests in Quantum Code: A Machine Learning Approach

arXiv.org Artificial Intelligence

Testing and debugging quantum software pose significant challenges due to the inherent complexities of quantum mechanics, such as superposition and entanglement. One challenge is indeterminacy, a fundamental characteristic of quantum systems, which increases the likelihood of flaky tests in quantum programs. To the best of our knowledge, there is a lack of comprehensive studies on quantum flakiness in the existing literature. In this paper, we present a novel machine learning platform that leverages multiple machine learning models to automatically detect flaky tests in quantum programs. Our evaluation shows that the extreme gradient boosting and decision tree-based models outperform other models (i.e., random forest, k-nearest neighbors, and support vector machine), achieving the highest F1 score and Matthews Correlation Coefficient in a balanced dataset and an imbalanced dataset, respectively. Furthermore, we expand the currently limited dataset for researchers interested in quantum flaky tests. In the future, we plan to explore the development of unsupervised learning techniques to detect and classify quantum flaky tests more effectively. These advancements aim to improve the reliability and robustness of quantum software testing.


Precision Agriculture Revolution: Integrating Digital Twins and Advanced Crop Recommendation for Optimal Yield

arXiv.org Artificial Intelligence

With the help of a digital twin structure, Agriculture 4.0 technologies like weather APIs (Application programming interface), GPS (Global Positioning System) modules, and NPK (Nitrogen, Phosphorus and Potassium) soil sensors and machine learning recommendation models, we seek to revolutionize agricultural production through this concept. In addition to providing precise crop growth forecasts, the combination of real-time data on soil composition, meteorological dynamics, and geographic coordinates aims to support crop recommendation models and simulate predictive scenarios for improved water and pesticide management.


BiMarker: Enhancing Text Watermark Detection for Large Language Models with Bipolar Watermarks

arXiv.org Artificial Intelligence

The rapid growth of Large Language Models (LLMs) raises concerns about distinguishing AI-generated text from human content. Existing watermarking techniques, like \kgw, struggle with low watermark strength and stringent false-positive requirements. Our analysis reveals that current methods rely on coarse estimates of non-watermarked text, limiting watermark detectability. To address this, we propose Bipolar Watermark (\tool), which splits generated text into positive and negative poles, enhancing detection without requiring additional computational resources or knowledge of the prompt. Theoretical analysis and experimental results demonstrate \tool's effectiveness and compatibility with existing optimization techniques, providing a new optimization dimension for watermarking in LLM-generated content.


Temporal Distribution Shift in Real-World Pharmaceutical Data: Implications for Uncertainty Quantification in QSAR Models

arXiv.org Artificial Intelligence

The estimation of uncertainties associated with predictions from quantitative structure-activity relationship (QSAR) models can accelerate the drug discovery process by identifying promising experiments and allowing an efficient allocation of resources. Several computational tools exist that estimate the predictive uncertainty in machine learning models. However, deviations from the i.i.d. setting have been shown to impair the performance of these uncertainty quantification methods. We use a real-world pharmaceutical dataset to address the pressing need for a comprehensive, large-scale evaluation of uncertainty estimation methods in the context of realistic distribution shifts over time. We investigate the performance of several uncertainty estimation methods, including ensemble-based and Bayesian approaches. Furthermore, we use this real-world setting to systematically assess the distribution shifts in label and descriptor space and their impact on the capability of the uncertainty estimation methods. Our study reveals significant shifts over time in both label and descriptor space and a clear connection between the magnitude of the shift and the nature of the assay. Moreover, we show that pronounced distribution shifts impair the performance of popular uncertainty estimation methods used in QSAR models. This work highlights the challenges of identifying uncertainty quantification methods that remain reliable under distribution shifts introduced by real-world data.


Towards Unified Music Emotion Recognition across Dimensional and Categorical Models

arXiv.org Artificial Intelligence

--One of the most significant challenges in Music Emotion Recognition (MER) comes from the fact that emotion labels can be heterogeneous across datasets with regard to the emotion representation, including categorical (e.g., happy, sad) versus dimensional labels (e.g., valence-arousal). In this paper, we present a unified multitask learning framework that combines these two types of labels and is thus able to be trained on multiple datasets. This framework uses an effective input representation that combines musical features (i.e., key and chords) and MERT embeddings. Moreover, knowledge distillation is employed to transfer the knowledge of teacher models trained on individual datasets to a student model, enhancing its ability to generalize across multiple tasks. T o validate our proposed framework, we conducted extensive experiments on a variety of datasets, including MTG-Jamendo, DEAM, PMEmo, and EmoMusic. According to our experimental results, the inclusion of musical features, multitask learning, and knowledge distillation significantly enhances performance. In particular, our model outperforms the state-of-the-art models on the MTG-Jamendo dataset. Our work makes a significant contribution to MER by allowing the combination of categorical and dimensional emotion labels in one unified framework, thus enabling training across datasets. I NTRODUCTION Music plays an essential role in influencing human emotions [36]. In the past decades, numerous Music Emotion Recognition (MER) models been developed.


Reviews: Classification Accuracy Score for Conditional Generative Models

Neural Information Processing Systems

The author proposed Classification Accuracy Score -- a metric that is based on a performance of a discriminative model that is trained on samples obtained from the conditional generative model. The paper also discussed pros and cons of the proposed metric. The empirical study shows that a number of sota-level deep generative models fail to match the target distribution. Pros: While the idea has been proposed before in Shmelkov2018, it was not widely used in the field. The current paper points out some limitations of deep generative models as well as limitations currently used metrics, thus the paper delivers a significant contribution.


Reviews: Classification Accuracy Score for Conditional Generative Models

Neural Information Processing Systems

The final version needs to be significantly revised to account for closely related work such as Shmelkov (2018). The novelty of the proposed metric is questionable and should not be misleading in the text. On the other hand, reviewers were impressed with the empirical evaluation, and felt that the paper would provide new insights to the NeurIPS community.


The Logical Implication Steering Method for Conditional Interventions on Transformer Generation

arXiv.org Artificial Intelligence

The field of mechanistic interpretability in pre-trained transformer models has demonstrated substantial evidence supporting the ''linear representation hypothesis'', which is the idea that high level concepts are encoded as vectors in the space of activations of a model. Studies also show that model generation behavior can be steered toward a given concept by adding the concept's vector to the corresponding activations. We show how to leverage these properties to build a form of logical implication into models, enabling transparent and interpretable adjustments that induce a chosen generation behavior in response to the presence of any given concept. Our method, Logical Implication Model Steering (LIMS), unlocks new hand engineered reasoning capabilities by integrating neuro-symbolic logic into pre-trained transformer models.


Reasoning-as-Logic-Units: Scaling Test-Time Reasoning in Large Language Models Through Logic Unit Alignment

arXiv.org Artificial Intelligence

Chain-of-Thought (CoT) prompting has shown promise in enhancing the reasoning capabilities of large language models (LLMs) by generating natural language (NL) rationales that lead to the final answer. However, it struggles with numerical computation, which has somehow led to the development of program-aided techniques. Despite their potential, a persistent challenge remains: inconsistencies between LLM-reported reasoning steps and the logic in generated programs, which we term ``reasoning hallucinations." This stems from the inherent ambiguities of NL and the statistical nature of LLMs, which often lack rigorous logical coherence. To address this challenge, we propose a novel test-time scaling framework, Reasoning-as-Logic-Units (RaLU), which constructs a more reliable reasoning path by aligning logical units between the generated program and their corresponding NL descriptions. By decomposing the initially generated program into discrete units using static analysis, RaLU engages in an iterative dialogue with the LLM to judge, refine, and explain each unit. A rewind-and-correct mechanism ensures alignment between code statements and task requirements in each unit, ultimately forming a cohesive reasoning path under the program's logic, from which the model reaches a final solution. Our experiments demonstrate that RaLU significantly outperforms existing baselines in mathematical reasoning (GSM8K, MATH) and algorithmic reasoning (HumanEval+, MBPP+), underscoring its potential to advance LLM reasoning and programming by offering enhanced accuracy and interpretability.


A Match Made in Heaven? Matching Test Cases and Vulnerabilities With the VUTECO Approach

arXiv.org Artificial Intelligence

Software vulnerabilities are commonly detected via static analysis, penetration testing, and fuzzing. They can also be found by running unit tests - so-called vulnerability-witnessing tests - that stimulate the security-sensitive behavior with crafted inputs. Developing such tests is difficult and time-consuming; thus, automated data-driven approaches could help developers intercept vulnerabilities earlier. However, training and validating such approaches require a lot of data, which is currently scarce. This paper introduces VUTECO, a deep learning-based approach for collecting instances of vulnerability-witnessing tests from Java repositories. VUTECO carries out two tasks: (1) the "Finding" task to determine whether a test case is security-related, and (2) the "Matching" task to relate a test case to the exact vulnerability it is witnessing. VUTECO successfully addresses the Finding task, achieving perfect precision and 0.83 F0.5 score on validated test cases in VUL4J and returning 102 out of 145 (70%) correct security-related test cases from 244 open-source Java projects. Despite showing sufficiently good performance for the Matching task - i.e., 0.86 precision and 0.68 F0.5 score - VUTECO failed to retrieve any valid match in the wild. Nevertheless, we observed that in almost all of the matches, the test case was still security-related despite being matched to the wrong vulnerability. In the end, VUTECO can help find vulnerability-witnessing tests, though the matching with the right vulnerability is yet to be solved; the findings obtained lay the stepping stone for future research on the matter.