edge flow
Vector Space of Cycles
Chung, Moo K., El-Yaagoubi, Anass B., Ombao, Hernando
Most statistical and machine learning methods for directed interactions focus on pairwise effects among variables. Even existing cyclic models represent feedback primarily through node-level dependencies, making large-scale recurrent organization difficult to estimate and compare. This limitation is particularly acute in biological and neural systems, where interactions are highly recurrent and involve many overlapping cycles. We introduce a variational framework for statistical inference on cyclic interactions. Directed interactions are represented as edge flows on a simplicial complex and evolved under an energy-minimizing dynamical system. The resulting dynamics separate transient interaction components from persistent harmonic flows, yielding a low-dimensional cycle space that captures stable recurrent organization. Rather than enumerating individual cycles, the proposed framework represents cyclic interactions as elements of a Hilbert space, enabling projection, averaging, comparison, and population-level statistical inference. We establish theoretical properties of the harmonic projection, including characterization of the cycle space, variance reduction, and population inference. Simulations demonstrate substantially improved recovery of cyclic structure in dense recurrent systems compared with existing directed-interaction methods. Applied to resting-state fMRI from 400 human subjects, the framework reveals reproducible large-scale cyclic organization that is not detectable through edgewise averaging. These results provide a scalable statistical framework for studying recurrent interactions in high-dimensional dynamical systems.
Physics-Informed Implicit Representations of Equilibrium Network Flows
Flow networks are ubiquitous in natural and engineered systems, and in order to understand and manage these networks, one must quantify the flow of commodities across their edges. This paper considers the estimation problem of predicting unlabeled edge flows from nodal supply and demand. We propose an implicit neural network layer that incorporates two fundamental physical laws: conservation of mass, and the existence of a constitutive relationship between edge flows and nodal states (e.g., Ohm's law). Computing the edge flows from these two laws is a nonlinear inverse problem, which our layer solves efficiently with a specialized contraction mapping. Using implicit differentiation to compute the solution's gradients, our model is able to learn the constitutive relationship within a semi-supervised framework. We demonstrate that our approach can accurately predict edge flows in several experiments on AC power networks and water distribution systems.
Topological Schr\"odinger Bridge Matching
Given two boundary distributions, the Schr\"odinger Bridge (SB) problem seeks the ``most likely`` random evolution between them with respect to a reference process. It has revealed rich connections to recent machine learning methods for generative modeling and distribution matching. While these methods perform well in Euclidean domains, they are not directly applicable to topological domains such as graphs and simplicial complexes, which are crucial for data defined over network entities, such as node signals and edge flows. In this work, we propose the Topological Schr\"odinger Bridge problem (TSBP) for matching signal distributions on a topological domain. We set the reference process to follow some linear tractable topology-aware stochastic dynamics such as topological heat diffusion. For the case of Gaussian boundary distributions, we derive a closed-form topological SB (TSB) in terms of its time-marginal and stochastic differential. In the general case, leveraging the well-known result, we show that the optimal process follows the forward-backward topological dynamics governed by some unknowns. Building on these results, we develop TSB-based models for matching topological signals by parameterizing the unknowns in the optimal process as (topological) neural networks and learning them through likelihood training. We validate the theoretical results and demonstrate the practical applications of TSB-based models on both synthetic and real-world networks, emphasizing the role of topology. Additionally, we discuss the connections of TSB-based models to other emerging models, and outline future directions for topological signal matching.
Physics-Informed Implicit Representations of Equilibrium Network Flows
Flow networks are ubiquitous in natural and engineered systems, and in order to understand and manage these networks, one must quantify the flow of commodities across their edges. This paper considers the estimation problem of predicting unlabeled edge flows from nodal supply and demand. We propose an implicit neural network layer that incorporates two fundamental physical laws: conservation of mass, and the existence of a constitutive relationship between edge flows and nodal states (e.g., Ohm's law). Computing the edge flows from these two laws is a nonlinear inverse problem, which our layer solves efficiently with a specialized contraction mapping. Using implicit differentiation to compute the solution's gradients, our model is able to learn the constitutive relationship within a semi-supervised framework.
Imputation of Time-varying Edge Flows in Graphs by Multilinear Kernel Regression and Manifold Learning
Nguyen, Duc Thien, Slavakis, Konstantinos, Pados, Dimitris
This paper extends the recently developed framework of multilinear kernel regression and imputation via manifold learning (MultiL-KRIM) to impute time-varying edge flows in a graph. MultiL-KRIM uses simplicial-complex arguments and Hodge Laplacians to incorporate the graph topology, and exploits manifold-learning arguments to identify latent geometries within features which are modeled as a point-cloud around a smooth manifold embedded in a reproducing kernel Hilbert space (RKHS). Following the concept of tangent spaces to smooth manifolds, linear approximating patches are used to add a collaborative-filtering flavor to the point-cloud approximations. Together with matrix factorizations, MultiL-KRIM effects dimensionality reduction, and enables efficient computations, without any training data or additional information. Numerical tests on real-network time-varying edge flows demonstrate noticeable improvements of MultiL-KRIM over several state-of-the-art schemes.
Hodge-Compositional Edge Gaussian Processes
Yang, Maosheng, Borovitskiy, Viacheslav, Isufi, Elvin
We propose principled Gaussian processes (GPs) for modeling functions defined over the edge set of a simplicial 2-complex, a structure similar to a graph in which edges may form triangular faces. This approach is intended for learning flow-type data on networks where edge flows can be characterized by the discrete divergence and curl. Drawing upon the Hodge decomposition, we first develop classes of divergence-free and curl-free edge GPs, suitable for various applications. We then combine them to create \emph{Hodge-compositional edge GPs} that are expressive enough to represent any edge function. These GPs facilitate direct and independent learning for the different Hodge components of edge functions, enabling us to capture their relevance during hyperparameter optimization. To highlight their practical potential, we apply them for flow data inference in currency exchange, ocean flows and water supply networks, comparing them to alternative models.
Hodge-Aware Contrastive Learning
Möllers, Alexander, Immer, Alexander, Fortuin, Vincent, Isufi, Elvin
Simplicial complexes prove effective in modeling data with multiway dependencies, such as data defined along the edges of networks or within other higher-order structures. Their spectrum can be decomposed into three interpretable subspaces via the Hodge decomposition, resulting foundational in numerous applications. We leverage this decomposition to develop a contrastive self-supervised learning approach for processing simplicial data and generating embeddings that encapsulate specific spectral information.Specifically, we encode the pertinent data invariances through simplicial neural networks and devise augmentations that yield positive contrastive examples with suitable spectral properties for downstream tasks. Additionally, we reweight the significance of negative examples in the contrastive loss, considering the similarity of their Hodge components to the anchor. By encouraging a stronger separation among less similar instances, we obtain an embedding space that reflects the spectral properties of the data. The numerical results on two standard edge flow classification tasks show a superior performance even when compared to supervised learning techniques. Our findings underscore the importance of adopting a spectral perspective for contrastive learning with higher-order data.
Distributional GFlowNets with Quantile Flows
Zhang, Dinghuai, Pan, Ling, Chen, Ricky T. Q., Courville, Aaron, Bengio, Yoshua
Generative Flow Networks (GFlowNets) are a new family of probabilistic samplers where an agent learns a stochastic policy for generating complex combinatorial structure through a series of decision-making steps. Despite being inspired from reinforcement learning, the current GFlowNet framework is relatively limited in its applicability and cannot handle stochasticity in the reward function. In this work, we adopt a distributional paradigm for GFlowNets, turning each flow function into a distribution, thus providing more informative learning signals during training. By parameterizing each edge flow through their quantile functions, our proposed \textit{quantile matching} GFlowNet learning algorithm is able to learn a risk-sensitive policy, an essential component for handling scenarios with risk uncertainty. Moreover, we find that the distributional approach can achieve substantial improvement on existing benchmarks compared to prior methods due to our enhanced training algorithm, even in settings with deterministic rewards.