Scientific Code Generation

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  1. Towards Certificate-Driven Software Porting: A Self-Improving Agentic Harness for Scientific Program Optimization

    Sep 28, 2026Piyush Jha, Aishik Ghosh, Vijay GaneshCode TranslationGPU Kernel Optimization

  2. SciWalker: Synthesizing Scientific Coding Problems with Operator Graphs and Execution Feedback

    Sep 24, 2026Chenxi Li, Wenxuan Zeng, Yun Luo +4Execution-Guided Code GenerationScientific Code Generation

  3. Idea Search: Guiding Tree Search with Ideas to Explore Diverse Scientific Methods

    Aug 9, 2026Xuefei Julie Wang, Hao Cui, Michael P. Brenner +1Inference-Time SearchAutomated Algorithm Discovery

  4. SciCode-Verified: How Benchmark Defects Underestimated the Scientific-Coding Ability of Language Models

    Aug 5, 2026Sihan Hu, Lyuhan Huang, Youjin Deng +1LLM EvaluationScientific Code Generation

  5. MDArena: Evaluating Coding Agents on Realistic Molecular Dynamics Workflows

    Jul 31, 2026Nithishwer Mouroug Anand, Wei-Tse Hsu, Kyle Vaccaro +6Coding AgentsScientific Code Generation

  6. Enhancing SLMs for Sustainable Code Optimization in Radio-Astronomy

    Jul 23, 2026Elisa Chiarotto, Jingbo Li, P. Chris Broekema +1Large Language Model-Guided OptimizationCode Generation

  7. Automated Synthesis and Adversarial Validation of Executable Causal Research Pipelines

    Jul 23, 2026Irena Girshovitz, Dan Zeltzer, Ran Gilad-BachrachAI-Assisted Scientific ResearchScientific Code Generation

  8. SciCodePile: A 128GB Corpus and Executable Benchmark for Challenging Scientific Code Generation

    Jul 21, 2026Weifeng Sun, Ye Fan, Yuchen Chen +6Scientific Code GenerationCode Generation Evaluation

  9. From Overload to Insights: How AI Agents Can Support Scientists in Analyzing Complex Data

    Jul 18, 2026Tim Fuchs, Luca Gelisio, Steffen Hauf +1AI for ScienceAI-Assisted Scientific Research

  10. LQCDMaster: Agentic Scientific Computing for Lattice Quantum Chromodynamics Research

    Jul 16, 2026Haofei Gao, Tingjia Miao, Wenkai Jin +12Scientific Code GenerationHigh-Energy Physics

  11. Reinforcement Learning with Verifiable Physics: Post-training LLMs with Continuous Rewards

    Jul 11, 2026Pengfei Cai, Utkarsh Utkarsh, Alan Edelman +2RL for Code GenerationScientific Code Generation

  12. Plainbook: Data Science, in Plain Language

    Jul 7, 2026Luca de Alfaro, Mathis Aubert, Ranjit Jhala +2Scientific Code GenerationScientific Reproducibility

  13. LLMoxie: Exploring Agentic AI for Scientific Software Development

    Jul 2, 2026Landung Setiawan, Anant Mittal, Cordero Core +5Scientific Code GenerationAI Agent Governance

  14. A Self-Evolving Agentic System for Automated Generation and Execution of Biological Protocols

    Jun 30, 2026Yankai Jiang, Weiting Tang, Haoran Sun +11Scientific Code GenerationLaboratory Automation

  15. Auto-Configuring Scientific Simulators with Lightweight Coding-Agent Adapters

    Jun 8, 2026Matthew Ho, Brian Liu, Jixuan Chen +2Coding AgentsScientific Code Generation

  16. A case study of evaluating AI agents on a neuroscience data-to-discovery pipeline

    Jun 5, 2026Kai A. Horstmann, Ethan Lin, Alice A. Robie +2AI Agent EvaluationScientific Code Generation

  17. GRAIL: AI translation for scientists application workflow on satellite data

    May 23, 2026Zhuocheng Shang, Ahmed EldawyCode TranslationScientific Code Generation

  18. CVEvolve: Autonomous Algorithm Discovery for Unstructured Scientific Data Processing

    May 12, 2026Ming Du, Xiangyu Yin, Yanqi Luo +4Automated Algorithm DiscoveryScientific Code Generation

  19. PDEAgent-Bench: A Multi-Metric, Multi-Library Benchmark for PDE Solver Generation

    May 10, 2026Zhen Hang, Yushan Yashengjiang, Junhui Li +21PDE SolvingBenchmark Design

  20. Your Simulation Runs but Solves the Wrong Physics: PDE-Grounded Intent Verification for LLM-Generated Multiphysics Simulation Code

    May 10, 2026Zhenghan Song, Yulong Liu, Cheng Wan +4LLM Self-CorrectionScientific Code Generation

  21. MolViBench: Evaluating LLMs on Molecular Vibe Coding

    May 4, 2026Jiatong Li, Yuxuan Ren, Weida Wang +4AI-Assisted Scientific ResearchScientific Code Generation

  22. HepScript: A Dual-Use DSL for Human-AI Collaborative Data Analysis Workflows in High-Energy Physics

    May 2, 2026Junkun Jiao, Tong Liu, Ke Li +6Scientific Code GenerationHigh-Energy Physics

  23. spectroxide: A code package for computing cosmic microwave background spectral distortions

    Apr 27, 2026Ethan Baker, Hongwan Liu, Siddharth Mishra-SharmaAI-Assisted Scientific ResearchScientific Code Generation

  24. No Test Cases, No Problem: Distillation-Driven Code Generation for Scientific Workflows

    Apr 25, 2026Siddeshwar Raghavan, Tanwi MallickMulti-Agent LLM SystemsCode Generation

  25. Agentic AI-assisted coding offers a unique opportunity to instill epistemic grounding during software development

    Apr 23, 2026Magnus Palmblad, Jared M. Ragland, Benjamin A. NeelyLLM GroundingScientific Code Generation

  26. El Agente Forjador: Task-Driven Agent Generation for Quantum Simulation

    Apr 16, 2026Zijian Zhang, Aiwei Yin, Amaan Baweja +4Multi-Agent LLM SystemsAI for Science