arXiv subjects

Mustafa Hajij

Publications and source records attributed to Mustafa Hajij.

At least 19 recordsLinked to original sources

arXiv2026

Topological Neural Operators

We introduce Topological Neural Operators (TNOs), a principled framework for operator learning on cell complexes that lifts neural operators (NOs) from functions on points and/or edges to topological domains. TNOs represent data as features defined on cells of varying dimension and model their interactions through Discrete Exterior Calculus, enabling explicit cross-dimensional coupling via gradient-, curl-, and divergence-type operators. The key design principle is to decouple where information flows, as governed by fixed topological operators, from how it is transformed (which is learned), yielding models that respect the geometric support of physical quantities and expose conservation and compatibility structure. We further propose Hierarchical TNOs (HTNOs), which incorporate learned coarse complexes to propagate long-range and topology-dependent information. Our framework subsumes existing NOs as a special case, providing a unified perspective on operator learning across discretizations. Across a range of PDE benchmarks, including irregular-geometry flow problems, TNOs and HTNOs improve accuracy; controlled studies further isolate the benefits of native higher-rank and topological structure. Project page: https://circle-group.github.io/research/TNO

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arXiv2026

TopoU-Net: a U-Net architecture for topological domains

Many modern datasets mix points, edges, regions, groups, objects, events, hyperedges, and relations. Yet neural architectures often force such data into grids, graphs, or sequences, obscuring higher-order structure and making encoder-decoder designs domain-specific. We view U-Net not as a grid-specific architecture, but as a hierarchical encoder-decoder principle: representation spaces, transport maps between levels, and skip connections between matched levels. Combinatorial complexes naturally supply these ingredients through cells, incidences, and ranks. We introduce TopoU-Net, a rank-path U-Net for topological domains. Given a path from an input rank to a bottleneck rank and back, the encoder lifts cochains upward along incidence maps, the decoder transports them downward, and skip connections merge features at matched ranks. Rank replaces spatial scale: choosing paths through nodes, edges, faces, hyperedges, or global cells becomes the central architectural decision. A key quantity is the bottleneck support ratio, the number of cells at the bottleneck relative to the number of cells at the input rank. This ratio is fixed by the complex and chosen path rather than by arbitrary pooling, and it clarifies when skip connections are optional, useful, or structurally important. Across node classification, graph classification, hypergraph node classification, mesh classification, and image reconstruction, TopoU-Net provides a reusable encoder-decoder template for higher-order structured data. Among the evaluated baselines, it achieves the strongest mean accuracy on six of eight node-classification datasets and four of five hypergraph datasets, with the largest gains on heterophilic graphs. Ablations show that removing skip connections is most damaging under severe bottleneck compression.

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arXiv2025

Topotein: Topological Deep Learning for Protein Representation Learning

Protein representation learning (PRL) is crucial for understanding structure-function relationships, yet current sequence- and graph-based methods fail to capture the hierarchical organization inherent in protein structures. We introduce Topotein, a comprehensive framework that applies topological deep learning to PRL through the novel Protein Combinatorial Complex (PCC) and Topology-Complete Perceptron Network (TCPNet). Our PCC represents proteins at multiple hierarchical levels -- from residues to secondary structures to complete proteins -- while preserving geometric information at each level. TCPNet employs SE(3)-equivariant message passing across these hierarchical structures, enabling more effective capture of multi-scale structural patterns. Through extensive experiments on four PRL tasks, TCPNet consistently outperforms state-of-the-art geometric graph neural networks. Our approach demonstrates particular strength in tasks such as fold classification which require understanding of secondary structure arrangements, validating the importance of hierarchical topological features for protein analysis.

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arXiv2025

Copresheaf Topological Neural Networks: A Generalized Deep Learning Framework

We introduce copresheaf topological neural networks (CTNNs), a powerful unifying framework that encapsulates a wide spectrum of deep learning architectures, designed to operate on structured data, including images, point clouds, graphs, meshes, and topological manifolds. While deep learning has profoundly impacted domains ranging from digital assistants to autonomous systems, the principled design of neural architectures tailored to specific tasks and data types remains one of the field's most persistent open challenges. CTNNs address this gap by formulating model design in the language of copresheaves, a concept from algebraic topology that generalizes most practical deep learning models in use today. This abstract yet constructive formulation yields a rich design space from which theoretically sound and practically effective solutions can be derived to tackle core challenges in representation learning, such as long-range dependencies, oversmoothing, heterophily, and non-Euclidean domains. Our empirical results on structured data benchmarks demonstrate that CTNNs consistently outperform conventional baselines, particularly in tasks requiring hierarchical or localized sensitivity. These results establish CTNNs as a principled multi-scale foundation for the next generation of deep learning architectures.

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arXiv2025

CalibRefine: Deep Learning-Based Online Automatic Targetless LiDAR-Camera Calibration with Iterative and Attention-Driven Post-Refinement

Accurate multi-sensor calibration is essential for deploying robust perception systems in applications such as autonomous driving and intelligent transportation. Existing LiDAR-camera calibration methods often rely on manually placed targets, preliminary parameter estimates, or intensive data preprocessing, limiting their scalability and adaptability in real-world settings. In this work, we propose a fully automatic, targetless, and online calibration framework, CalibRefine, which directly processes raw LiDAR point clouds and camera images. Our approach is divided into four stages: (1) a Common Feature Discriminator that leverages relative spatial positions, visual appearance embeddings, and semantic class cues to identify and generate reliable LiDAR-camera correspondences, (2) a coarse homography-based calibration that uses the matched feature correspondences to estimate an initial transformation between the LiDAR and camera frames, serving as the foundation for further refinement, (3) an iterative refinement to incrementally improve alignment as additional data frames become available, and (4) an attention-based refinement that addresses non-planar distortions by leveraging a Vision Transformer and cross-attention mechanisms. Extensive experiments on two urban traffic datasets demonstrate that CalibRefine achieves high-precision calibration with minimal human input, outperforming state-of-the-art targetless methods and matching or surpassing manually tuned baselines. Our results show that robust object-level feature matching, combined with iterative refinement and self-supervised attention-based refinement, enables reliable sensor alignment in complex real-world conditions without ground-truth matrices or elaborate preprocessing. Code is available at https://github.com/radar-lab/Lidar_Camera_Automatic_Calibration

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arXiv2024

ICML Topological Deep Learning Challenge 2024: Beyond the Graph Domain

This paper describes the 2nd edition of the ICML Topological Deep Learning Challenge that was hosted within the ICML 2024 ELLIS Workshop on Geometry-grounded Representation Learning and Generative Modeling (GRaM). The challenge focused on the problem of representing data in different discrete topological domains in order to bridge the gap between Topological Deep Learning (TDL) and other types of structured datasets (e.g. point clouds, graphs). Specifically, participants were asked to design and implement topological liftings, i.e. mappings between different data structures and topological domains --like hypergraphs, or simplicial/cell/combinatorial complexes. The challenge received 52 submissions satisfying all the requirements. This paper introduces the main scope of the challenge, and summarizes the main results and findings.

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arXiv2024

TopoBench: A Framework for Benchmarking Topological Deep Learning

This work introduces TopoBench, an open-source library designed to standardize benchmarking and accelerate research in topological deep learning (TDL). TopoBench decomposes TDL into a sequence of independent modules for data generation, loading, transforming and processing, as well as model training, optimization and evaluation. This modular organization provides flexibility for modifications and facilitates the adaptation and optimization of various TDL pipelines. A key feature of TopoBench is its support for transformations and lifting across topological domains. Mapping the topology and features of a graph to higher-order topological domains, such as simplicial and cell complexes, enables richer data representations and more fine-grained analyses. The applicability of TopoBench is demonstrated by benchmarking several TDL architectures across diverse tasks and datasets.

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arXiv2024

Attending to Topological Spaces: The Cellular Transformer

Topological Deep Learning seeks to enhance the predictive performance of neural network models by harnessing topological structures in input data. Topological neural networks operate on spaces such as cell complexes and hypergraphs, that can be seen as generalizations of graphs. In this work, we introduce the Cellular Transformer (CT), a novel architecture that generalizes graph-based transformers to cell complexes. First, we propose a new formulation of the usual self- and cross-attention mechanisms, tailored to leverage incidence relations in cell complexes, e.g., edge-face and node-edge relations. Additionally, we propose a set of topological positional encodings specifically designed for cell complexes. By transforming three graph datasets into cell complex datasets, our experiments reveal that CT not only achieves state-of-the-art performance, but it does so without the need for more complex enhancements such as virtual nodes, in-domain structural encodings, or graph rewiring.

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arXiv2024

Position: Topological Deep Learning is the New Frontier for Relational Learning

Topological deep learning (TDL) is a rapidly evolving field that uses topological features to understand and design deep learning models. This paper posits that TDL is the new frontier for relational learning. TDL may complement graph representation learning and geometric deep learning by incorporating topological concepts, and can thus provide a natural choice for various machine learning settings. To this end, this paper discusses open problems in TDL, ranging from practical benefits to theoretical foundations. For each problem, it outlines potential solutions and future research opportunities. At the same time, this paper serves as an invitation to the scientific community to actively participate in TDL research to unlock the potential of this emerging field.

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arXiv2024

TopoX: A Suite of Python Packages for Machine Learning on Topological Domains

We introduce TopoX, a Python software suite that provides reliable and user-friendly building blocks for computing and machine learning on topological domains that extend graphs: hypergraphs, simplicial, cellular, path and combinatorial complexes. TopoX consists of three packages: TopoNetX facilitates constructing and computing on these domains, including working with nodes, edges and higher-order cells; TopoEmbedX provides methods to embed topological domains into vector spaces, akin to popular graph-based embedding algorithms such as node2vec; TopoModelX is built on top of PyTorch and offers a comprehensive toolbox of higher-order message passing functions for neural networks on topological domains. The extensively documented and unit-tested source code of TopoX is available under MIT license at https://pyt-team.github.io/}{https://pyt-team.github.io/.

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arXiv2023

Topo-MLP : A Simplicial Network Without Message Passing

Due to their ability to model meaningful higher order relations among a set of entities, higher order network models have emerged recently as a powerful alternative for graph-based network models which are only capable of modeling binary relationships. Message passing paradigm is still dominantly used to learn representations even for higher order network models. While powerful, message passing can have disadvantages during inference, particularly when the higher order connectivity information is missing or corrupted. To overcome such limitations, we propose Topo-MLP, a purely MLP-based simplicial neural network algorithm to learn the representation of elements in a simplicial complex without explicitly relying on message passing. Our framework utilizes a novel Higher Order Neighborhood Contrastive (HONC) loss which implicitly incorporates the simplicial structure into representation learning. Our proposed model's simplicity makes it faster during inference. Moreover, we show that our model is robust when faced with missing or corrupted connectivity structure.

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arXiv2023

Combinatorial Complexes: Bridging the Gap Between Cell Complexes and Hypergraphs

Graph-based signal processing techniques have become essential for handling data in non-Euclidean spaces. However, there is a growing awareness that these graph models might need to be expanded into `higher-order' domains to effectively represent the complex relations found in high-dimensional data. Such higher-order domains are typically modeled either as hypergraphs, or as simplicial, cubical or other cell complexes. In this context, cell complexes are often seen as a subclass of hypergraphs with additional algebraic structure that can be exploited, e.g., to develop a spectral theory. In this article, we promote an alternative perspective. We argue that hypergraphs and cell complexes emphasize \emph{different} types of relations, which may have different utility depending on the application context. Whereas hypergraphs are effective in modeling set-type, multi-body relations between entities, cell complexes provide an effective means to model hierarchical, interior-to-boundary type relations. We discuss the relative advantages of these two choices and elaborate on the previously introduced concept of a combinatorial complex that enables co-existing set-type and hierarchical relations. Finally, we provide a brief numerical experiment to demonstrate that this modelling flexibility can be advantageous in learning tasks.

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arXiv2023

ICML 2023 Topological Deep Learning Challenge : Design and Results

This paper presents the computational challenge on topological deep learning that was hosted within the ICML 2023 Workshop on Topology and Geometry in Machine Learning. The competition asked participants to provide open-source implementations of topological neural networks from the literature by contributing to the python packages TopoNetX (data processing) and TopoModelX (deep learning). The challenge attracted twenty-eight qualifying submissions in its two-month duration. This paper describes the design of the challenge and summarizes its main findings.

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arXiv2023

Homology-Preserving Multi-Scale Graph Skeletonization Using Mapper on Graphs

Node-link diagrams are a popular method for representing graphs that capture relationships between individuals, businesses, proteins, and telecommunication endpoints. However, node-link diagrams may fail to convey insights regarding graph structures, even for moderately sized data of a few hundred nodes, due to visual clutter. We propose to apply the mapper construction -- a popular tool in topological data analysis -- to graph visualization, which provides a strong theoretical basis for summarizing the data while preserving their core structures. We develop a variation of the mapper construction targeting weighted, undirected graphs, called {\mog}, which generates homology-preserving skeletons of graphs. We further show how the adjustment of a single parameter enables multi-scale skeletonization of the input graph. We provide a software tool that enables interactive explorations of such skeletons and demonstrate the effectiveness of our method for synthetic and real-world data.

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arXiv2023

Topological Deep Learning: Going Beyond Graph Data

Topological deep learning is a rapidly growing field that pertains to the development of deep learning models for data supported on topological domains such as simplicial complexes, cell complexes, and hypergraphs, which generalize many domains encountered in scientific computations. In this paper, we present a unifying deep learning framework built upon a richer data structure that includes widely adopted topological domains. Specifically, we first introduce combinatorial complexes, a novel type of topological domain. Combinatorial complexes can be seen as generalizations of graphs that maintain certain desirable properties. Similar to hypergraphs, combinatorial complexes impose no constraints on the set of relations. In addition, combinatorial complexes permit the construction of hierarchical higher-order relations, analogous to those found in simplicial and cell complexes. Thus, combinatorial complexes generalize and combine useful traits of both hypergraphs and cell complexes, which have emerged as two promising abstractions that facilitate the generalization of graph neural networks to topological spaces. Second, building upon combinatorial complexes and their rich combinatorial and algebraic structure, we develop a general class of message-passing combinatorial complex neural networks (CCNNs), focusing primarily on attention-based CCNNs. We characterize permutation and orientation equivariances of CCNNs, and discuss pooling and unpooling operations within CCNNs in detail. Third, we evaluate the performance of CCNNs on tasks related to mesh shape analysis and graph learning. Our experiments demonstrate that CCNNs have competitive performance as compared to state-of-the-art deep learning models specifically tailored to the same tasks. Our findings demonstrate the advantages of incorporating higher-order relations into deep learning models in different applications.

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arXiv2023

Architectures of Topological Deep Learning: A Survey of Message-Passing Topological Neural Networks

The natural world is full of complex systems characterized by intricate relations between their components: from social interactions between individuals in a social network to electrostatic interactions between atoms in a protein. Topological Deep Learning (TDL) provides a comprehensive framework to process and extract knowledge from data associated with these systems, such as predicting the social community to which an individual belongs or predicting whether a protein can be a reasonable target for drug development. TDL has demonstrated theoretical and practical advantages that hold the promise of breaking ground in the applied sciences and beyond. However, the rapid growth of the TDL literature for relational systems has also led to a lack of unification in notation and language across message-passing Topological Neural Network (TNN) architectures. This presents a real obstacle for building upon existing works and for deploying message-passing TNNs to new real-world problems. To address this issue, we provide an accessible introduction to TDL for relational systems, and compare the recently published message-passing TNNs using a unified mathematical and graphical notation. Through an intuitive and critical review of the emerging field of TDL, we extract valuable insights into current challenges and exciting opportunities for future development.

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arXiv2022

Signal Processing on Cell Complexes

The processing of signals supported on non-Euclidean domains has attracted large interest recently. Thus far, such non-Euclidean domains have been abstracted primarily as graphs with signals supported on the nodes, though the processing of signals on more general structures such as simplicial complexes has also been considered. In this paper, we give an introduction to signal processing on (abstract) regular cell complexes, which provide a unifying framework encompassing graphs, simplicial complexes, cubical complexes and various meshes as special cases. We discuss how appropriate Hodge Laplacians for these cell complexes can be derived. These Hodge Laplacians enable the construction of convolutional filters, which can be employed in linear filtering and non-linear filtering via neural networks defined on cell complexes.

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arXiv2022

Simplicial Complex Representation Learning

Simplicial complexes form an important class of topological spaces that are frequently used in many application areas such as computer-aided design, computer graphics, and simulation. Representation learning on graphs, which are just 1-d simplicial complexes, has witnessed a great attention in recent years. However, there has not been enough effort to extend representation learning to higher dimensional simplicial objects due to the additional complexity these objects hold, especially when it comes to entire-simplicial complex representation learning. In this work, we propose a method for simplicial complex-level representation learning that embeds a simplicial complex to a universal embedding space in a way that complex-to-complex proximity is preserved. Our method uses our novel geometric message passing schemes to learn an entire simplicial complex representation in an end-to-end fashion. We demonstrate the proposed model on publicly available mesh dataset. To the best of our knowledge, this work presents the first method for learning simplicial complex-level representation.

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