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LLMs show strong performance in code generation, but their outputs lack correctness guarantees. Sample-based uncertainty estimators address this by generating multiple candidate programs and measuring their disagreement. However, existing…

Software Engineering · Computer Science 2026-05-12 Weilin He , Arindam Sharma , Cristina David

Investigating uncertainties in computer simulations can be prohibitive in terms of computational costs, since the simulator needs to be run over a large number of input values. Building an emulator, i.e. a statistical surrogate model of the…

Methodology · Statistics 2022-10-18 Ayao Ehara , Serge Guillas

Large language models (LLMs) have recently demonstrated a remarkable ability to generate code from natural language (NL) prompts. However, in the real world, NL is often too ambiguous to capture the true intent behind programming problems,…

Machine Learning · Computer Science 2024-03-18 Yeming Wen , Pengcheng Yin , Kensen Shi , Henryk Michalewski , Swarat Chaudhuri , Alex Polozov

Simulation is a foundational tool for the analysis and testing of cyber-physical systems (CPS), underpinning activities such as algorithm development, runtime monitoring, and system verification. As CPS grow in complexity and scale,…

Software Engineering · Computer Science 2025-06-13 Quinn Thibeault , Giulia Pedrielli

Large Language Models (LLMs) have made significant strides in code generation and problem solving. Current approaches employ external tool-based iterative debuggers that use compiler or other tool-based runtime feedback to refine coarse…

Computation and Language · Computer Science 2026-04-28 Md. Ashraful Islam , Mohammed Eunus Ali , Md Rizwan Parvez

We have witnessed remarkable advances in LLM reasoning capabilities with the advent of DeepSeek-R1. However, much of this progress has been fueled by the abundance of internet question-answer (QA) pairs, a major bottleneck going forward,…

Fully automated verification of large-scale software and hardware systems is arguably the holy grail of formal methods. Large language models (LLMs) have recently demonstrated their potential for enhancing the degree of automation in formal…

Software Engineering · Computer Science 2026-03-11 Zhongyi Wang , Tengjie Lin , Mingshuai Chen , Haokun Li , Mingqi Yang , Xiao Yi , Shengchao Qin , Yixing Luo , Xiaofeng Li , Bin Gu , Liqiang Lu , Jianwei Yin

Solving diverse partial differential equations (PDEs) is fundamental in science and engineering. Large language models (LLMs) have demonstrated strong capabilities in code generation, symbolic reasoning, and tool use, but reliably solving…

Machine Learning · Computer Science 2026-04-24 Zhuoyuan Wang , Hanjiang Hu , Xiyu Deng , Saviz Mowlavi , Yorie Nakahira

Multiphysics simulation frameworks such as MOOSE provide rigorous engines for phase-field materials modeling, yet adoption is constrained by the expertise required to construct valid input files, coordinate parameter sweeps, diagnose…

Artificial Intelligence · Computer Science 2026-03-24 Sukriti Manna , Henry Chan , Subramanian K. R. S. Sankaranarayanan

The integration of Formal Verification tools with Large Language Models (LLMs) offers a path to scale software verification beyond manual workflows. However, current methods remain unreliable: without a solid theoretical footing, the…

Artificial Intelligence · Computer Science 2025-12-18 PIerre Dantas , Lucas Cordeiro , Youcheng Sun , Waldir Junior

Physics Engines (PEs) are fundamental software frameworks that simulate physical interactions in applications ranging from entertainment to safety-critical systems. Despite their importance, PEs suffer from physics failures, deviations from…

Computer Vision and Pattern Recognition · Computer Science 2025-07-31 Shuqing Li , Qiang Chen , Xiaoxue Ren , Michael R. Lyu

Unlike code completion, debugging requires localizing faults and applying targeted edits. We observe that frontier LLMs often regenerate correct but over-edited solutions during debugging. To evaluate how far LLMs are from precise…

Software Engineering · Computer Science 2026-05-19 Wang Bill Zhu , Miaosen Chai , Shangshang Wang , Yejia Liu , Song Bian , Honghua Dong , Willie Neiswanger , Robin Jia

Complex phenomena in engineering and the sciences are often modeled with computationally intensive feed-forward simulations for which a tractable analytic likelihood does not exist. In these cases, it is sometimes necessary to estimate an…

Methodology · Statistics 2020-06-18 Niccolò Dalmasso , Ann B. Lee , Rafael Izbicki , Taylor Pospisil , Ilmun Kim , Chieh-An Lin

Code generation models can benefit data scientists' productivity by automatically generating code from context and text descriptions. An important measure of the modeling progress is whether a model can generate code that can correctly…

Software Engineering · Computer Science 2022-11-18 Junjie Huang , Chenglong Wang , Jipeng Zhang , Cong Yan , Haotian Cui , Jeevana Priya Inala , Colin Clement , Nan Duan , Jianfeng Gao

Reconstructing PDE-governed fields from sparse and irregular measurements is challenging due to their ill-posed nature. Deterministic surrogates are trained on dense fields that struggle with limited measurements and uncertainty…

Machine Learning · Computer Science 2026-05-18 Hao Zhou , Rui Zhang , Han Wan , Hao Sun

In recent years, large language models have been widely integrated into software engineering workflows, supporting tasks like code generation. While prior evaluations focus on functional correctness, there is still a limited understanding…

Software Engineering · Computer Science 2026-04-23 Xin Sun , Daniel Ståhl , Kristian Sandahl , Christoph Kessler

Flow Matching (FM) models achieve remarkable results in generative tasks. Building upon diffusion models, FM's simulation-free training paradigm enables simplicity and efficiency but introduces a train-inference gap: model outputs cannot be…

Machine Learning · Computer Science 2026-01-30 Zhaoyi Li , Jingtao Ding , Yong Li , Shihua Li

Large Language Models (LLMs) have demonstrated remarkable capabilities across various domains, including software development, education, and technical assistance. Among these, software development is one of the key areas where LLMs are…

Computation and Language · Computer Science 2026-01-07 Inpyo Song , Eunji Jeon , Jangwon Lee

Code LLMs have shown promising results with converting tasks in natural language to programs that can be executed by service robots. We are interested in finetuning small, specialized LLMs for this purpose, but collecting datasets of…

Computation and Language · Computer Science 2025-10-13 Zichao Hu , Junyi Jessy Li , Arjun Guha , Joydeep Biswas

Pre-trained code language models have achieved promising performance in code generation and improved the programming efficiency of human developers. However, their self-refinement capability is typically overlooked by the existing…

Software Engineering · Computer Science 2024-03-28 Yangruibo Ding , Marcus J. Min , Gail Kaiser , Baishakhi Ray