Multi-Agent Specification-based Metamorphic Testing of FMU-Based Simulations
Authors: Ashir Kulshreshtha, Abdullah Mughees, Gaadha Sudheerbabu, Tanwir Ahmad, Kristian Klemets, Dragos Truscan, Mikael Manngård
Organizations: Abo Akademi University, Finland · University of Turku, Finland · Novia University of Applied Sciences, Finland
Abstract
In many industrial domains, the Functional Mock-up Interface (FMI) is used to exchange simulation models as Functional Mock-up Units (FMUs) across different partners using various modelling tools. This opens up the possibilities for simulation-based verification and validation using FMUs for ensuring reliable system behaviour. However, deriving effective test oracles for these simulation models remains challenging due to the absence of explicit expected outputs. This limits the applicability of conventional testing approaches, which require access to the internal workings of the systems. Metamorphic testing (MT) addresses this limitation by leveraging metamorphic relations (MRs), but extracting such relations from specifications remains largely a manual and error-prone process. To address this challenge, we propose an LLM-powered multi-agent workflow for specification-based metamorphic testing of FMU-based simulation models. The approach takes functional and interface specifications as input and orchestrates multiple agents to extract requirements and derive MRs. These MRs are expressed using Given-When-Then patterns to structure input conditions (Given), transformations (When), and expected output behaviours (Then). These relations are then used to generate metamorphic test cases, execute simulations, and evaluate output consistency across multiple sessions. We evaluate the approach on a Lube Oil Cooling system FMU, demonstrating its ability to automatically generate meaningful MRs and corresponding test cases. Preliminary results indicate that the proposed workflow can effectively support the systematic verification and validation of dynamic simulation models by reducing manual effort and improving test generation.
As REST APIs become an increasingly significant part of software systems, their validation is becoming more critical. Hence, testing and uncovering underlying issues are of utmost importance for improving software quality. However, testing REST APIs is challenging mainly due to the difficulty of assessing whether the output of an API call is correct, i.e., the test oracle problem. Metamorphic testing is a specification-based testing approach for situations where correct outputs are unknown or not specified explicitly. To check the correctness of a system, relations between the different outputs are specified. We present ARMeta, a tool-supported approach that uses an LLM-based multi-agent workflow to support metamorphic testing of REST APIs documented with OpenAPI. The agentic workflow is used to identify metamorphic test scenarios and specify them in the Given-When-Then format. These scenarios are automatically implemented as executable tests and executed against the system under test. We evaluate ARMeta on two publicly available web applications that expose REST interfaces and compare its performance with a scenario-based testing baseline. The results show that ARMeta explores behaviors that serve as a complement to existing scenario-based testing approaches.
Shehroz Khan, Abdullah Mughees, Gaadha Sudheerbabu +2
Context. Metamorphic Testing addresses the test-oracle problem in scientific computing, but classical Mutation Score operates on syntactic AST mutations and misses domain semantics. Objective. We propose the Semantic Mutation Score (SMS), built on five domain-semantic operators (Conservation Erosion, Operator Substitution, Hyperparameter, Trajectory Flip, Structural Injection). SMS degenerates almost everywhere to MS in a characterised limit, so any SMS-based conclusion remains consistent with prior mutation-testing literature in the classical regime. Method. A 12-PUT x 5-MP design over four single-output float-to-float classes (numeric, probabilistic, surrogate, machine-learning) is paired with a three-layer attribution classifier separating true semantic faults from tolerance, OOD, statistical, and artefact categories. A same-source / cross-source ablation under an identical prompt isolates the LLM-source-diversity contribution. LLM-generated mutants are compared against a default-configuration cosmic-ray syntactic pool at the AST-normalised level. Results. The pre-registered large-effect threshold for Cliff's delta is not met under the point-estimate criterion; the observed effect lies in the medium-effect range. Cross-source pooling under an identical prompt does not appreciably shift delta, indicating that LLM identity is not the lever within this design. AST-level overlap between LLM-generated and default cosmic-ray syntactic mutants is small; the Hyperparameter, Structural Injection, and Trajectory Flip classes are unreachable under default first-order syntactic configurations. Conclusion. SMS is a backward-compatible adequacy metric for domain-semantic metamorphic-relation sets in scientific computing. The first-order unreachability evidence is independent of the effect-size question.
Formal specification is essential for rigorous program verification, yet writing correct specifications remains costly and difficult to automate. Although large language models (LLMs) and agents have shown promising progress, their true capabilities and failure modes remain unclear. We present the first systematic and contamination-aware study of LLM- and agent-based formal specification generation for C programs. We introduce LiveFMBench, a continuously evolving benchmark of 630 ACSL (ANSI/ISO C Specification Language)-annotated C programs, including 360 newly collected cases designed to mitigate data leakage. Using this benchmark, we evaluate direct prompting with different sampling sizes, reasoning-enabled (thinking mode) inference, the agentic pipeline, and perform a fine-grained failure analysis. Experimental results reveal that naive evaluation substantially overestimates performance because models under direct prompting may exhibit unfaithful behaviors, such as deceiving automated provers or ignoring code-context constraints; after excluding such cases, the true specification generation accuracy drops by approximately 20%. We further find that both increased sampling and thinking mode significantly improve success rates, with smaller models benefiting more from thinking mode. Agentic pipelines are particularly effective under low sampling budgets and on harder datasets. Failure analysis further shows that incorrect loop invariants are the dominant error type, while agentic pipelines notably reduce assertion errors. These results expose fundamental limitations in current LLM-based approaches and suggest they remain far from replacing human-authored formal specifications. We release LiveFMBench at https://huggingface.co/datasets/fm-universe/Live-FM-Bench and all evaluation artifacts to support future research.