arXiv:2605. 21247v3 Announce Type: replace Abstract: Graph Neural Networks (GNNs) have emerged as a cornerstone of deep learning, with most existing methods rooted in graph signal processing and diffusion equations to model message passing.
By Zexing Zhao, Guangsi Shi, Yu Gong, Tianyu Wang, Shirui Pan, Hongye Cheng, Yuxiao Li
The book "The Principles of Diffusion Models" outlines the foundational concepts behind diffusion models, tracing their evolution from a forward process that corrupts data into noise to a reverse process that reconstructs data. It presents three complementary perspectives—variational, score-based, and flow-based—each describing how a time-dependent velocity field transports a simple prior to the data distribution. The text also covers practical guidance for controllable generation, efficient solvers, and diffusion-inspired flow-map models, providing a mathematically grounded framework for readers with basic deep‑learning knowledge.
By Chieh-Hsin Lai, Yang Song, Dongjun Kim, Yuki Mitsufuji, Stefano Ermon
arXiv:2609.08947v1 Announce Type: cross
Abstract: Graph-based surrogate models offer a promising route to accelerate computational fluid dynamics (CFD) simulations on unstructured meshes. However, th...
By Th\'eodore Michel, Antoine Campos, Alban Dujardin, Henry Areiza, Philippe Meliga, Elie Hachem
arXiv:2509.06154v3 Announce Type: replace
Abstract: Developing accurate, data-efficient surrogate models is central to advancing AI for Science. Neural operators (NOs), which approximate mappings bet...
By Dibyajyoti Nayak, Somdatta Goswami
arXiv:2608.27883v1 Announce Type: new
Abstract: Physical systems are often modeled by solution operators that map input fields, parameters, geometries, or past states to steady or future physical sta...
By Rajat Sarkar, Venkataramana Runkana, Souvik Chakraborty
arXiv:2603. 08825v2 Announce Type: replace-cross Abstract: Discrete graph generation has emerged as a powerful paradigm for modeling graph-structured data, yet state of the art models often rely on Graph Transformers or higher order architectures.
By Jay Revolinsky, Harry Shomer, Jiliang Tang
arXiv:2510. 14190v3 Announce Type: replace Abstract: Diffusion models excel at generation, but their latent spaces are high dimensional and not explicitly organized for interpretation or control.
By Ruchi Sandilya, Sumaira Perez, Charles Lynch, Lindsay Victoria, Benjamin Zebley, Derrick Matthew Buchanan, Mahendra T. Bhati, Nolan Williams, Timothy J. Spellman, Faith M. Gunning, Conor Liston, Logan Grosenick
Industrial design in fields such as vehicle and aerospace engineering often relies on large-scale numerical simulations to evaluate fluid dynamics performance, which can incur substantial computational costs. Deep neural networks have shown promise in improving simulation efficiency, especially graph neural networks (GNNs), which demonstrate great potential due to their flexibility with unstructured data.
GRIFDIR is a new architecture for score-based diffusion models that operates directly on unstructured meshes, enabling function-space diffusion over irregular domains. By representing generalized graph convolutional kernels as finite element functions, the model achieves resolution invariance and can handle complex, non-convex, and multiply-connected geometries. Experiments demonstrate that GRIFDIR maintains high fidelity in both unconditional and conditional sampling across diverse shapes.
By James Rowbottom, Elizabeth L. Baker, Nick Huang, Ben Adcock, Carola-Bibiane Sch\"onlieb, Alexander Denker
arXiv:2609.39739v1 Announce Type: new
Abstract: Graph generative models increasingly rely on Graph Transformers (GT) to capture complex dependencies among nodes and edges. While deeper architectures...
By Luca Miglior, Alessio Gravina, Davide Bacciu
arXiv:2607. 05167v1 Announce Type: new Abstract: Many real-world systems are organized as networks where spatio-temporal dynamics unfold along connections and not discretely between nodes.
By Janine Strotherm, Luca Hermes, Andr\'e Artelt, Barbara Hammer
arXiv:2607. 20535v1 Announce Type: cross Abstract: Traditional Predictive Digital Twins often remain geometrically rigid, requiring extensive retraining or fine-tuning whenever the underlying physical domain or boundary conditions change.
By Alicia Tierz, Ic\'iar Alfaro, David Gonz\'alez, El\'ias Cueto