MINAR: Mechanistic Interpretability for Neural Algorithmic ReasoningJesse He, Helen Jenne, Max Vargas et al.
The recent field of neural algorithmic reasoning (NAR) studies the ability of graph neural networks (GNNs) to emulate classical algorithms like Bellman-Ford, a phenomenon known as algorithmic alignment. At the same time, recent advances in large language models (LLMs) have spawned the study of mechanistic interpretability, which aims to identify granular model components like circuits that perform specific computations. In this work, we introduce Mechanistic Interpretability for Neural Algorithmic Reasoning (MINAR), an efficient circuit discovery toolbox that adapts attribution patching methods from mechanistic interpretability to the GNN setting. We show through two case studies that MINAR recovers faithful neuron-level circuits from GNNs trained on algorithmic tasks. Our study sheds new light on the process of circuit formation and pruning during training, as well as giving new insight into how GNNs trained to perform multiple tasks in parallel reuse circuit components for related tasks. Our code is available at https://github.com/pnnl/MINAR.
4.3CONov 26, 2025
Even with AI, Bijection Discovery is Still Hard: The Opportunities and Challenges of OpenEvolve for Novel Bijection ConstructionDavis Brown, Jesse He, Helen Jenne et al.
Evolutionary program synthesis systems such as AlphaEvolve, OpenEvolve, and ShinkaEvolve offer a new approach to AI-assisted mathematical discovery. These systems utilize teams of large language models (LLMs) to generate candidate solutions to a problem as human readable code. These candidate solutions are then 'evolved' with the goal of improving them beyond what an LLM can produce in a single shot. While existing mathematical applications have mostly focused on problems of establishing bounds (e.g., sphere packing), the program synthesis approach is well suited to any problem where the solution takes the form of an explicit construction. With this in mind, in this paper we explore the use of OpenEvolve for combinatorial bijection discovery. We describe the results of applying OpenEvolve to three bijection construction problems involving Dyck paths, two of which are known and one of which is open. We find that while systems like OpenEvolve show promise as a valuable tool for combinatorialists, the problem of finding novel, research-level bijections remains a challenging task for current frontier systems, reinforcing the need for human mathematicians in the loop. We describe some lessons learned for others in the field interested in exploring the use of these systems.
1.5CVOct 31, 2023
Using Skew to Assess the Quality of GAN-generated Image FeaturesLorenzo Luzi, Helen Jenne, Ryan Murray et al.
The rapid advancement of Generative Adversarial Networks (GANs) necessitates the need to robustly evaluate these models. Among the established evaluation criteria, the FréchetInception Distance (FID) has been widely adopted due to its conceptual simplicity, fast computation time, and strong correlation with human perception. However, FID has inherent limitations, mainly stemming from its assumption that feature embeddings follow a Gaussian distribution, and therefore can be defined by their first two moments. As this does not hold in practice, in this paper we explore the importance of third-moments in image feature data and use this information to define a new measure, which we call the Skew Inception Distance (SID). We prove that SID is a pseudometric on probability distributions, show how it extends FID, and present a practical method for its computation. Our numerical experiments support that SID either tracks with FID or, in some cases, aligns more closely with human perception when evaluating image features of ImageNet data. Our work also shows that principal component analysis can be used to speed up the computation time of both FID and SID. Although we focus on using SID on image features for GAN evaluation, SID is applicable much more generally, including for the evaluation of other generative models.
6.4LGNov 12, 2024
Machines and Mathematical Mutations: Using GNNs to Characterize Quiver Mutation ClassesJesse He, Helen Jenne, Herman Chau et al.
Machine learning is becoming an increasingly valuable tool in mathematics, enabling one to identify subtle patterns across collections of examples so vast that they would be impossible for a single researcher to feasibly review and analyze. In this work, we use graph neural networks to investigate \emph{quiver mutation} -- an operation that transforms one quiver (or directed multigraph) into another -- which is central to the theory of cluster algebras with deep connections to geometry, topology, and physics. In the study of cluster algebras, the question of \emph{mutation equivalence} is of fundamental concern: given two quivers, can one efficiently determine if one quiver can be transformed into the other through a sequence of mutations? In this paper, we use graph neural networks and AI explainability techniques to independently discover mutation equivalence criteria for quivers of type $\tilde{D}$. Along the way, we also show that even without explicit training to do so, our model captures structure within its hidden representation that allows us to reconstruct known criteria from type $D$, adding to the growing evidence that modern machine learning models are capable of learning abstract and parsimonious rules from mathematical data.