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stat.ML updates on arXiv.org

Adaptive multi-fidelity optimization with fast learning rates Enhancing AI and Dynamical Subseasonal Forecasts with Probabilistic Bias Correction Sample Complexity Bounds for Stochastic Shortest Path with a Generative Model The Harder Path: Last Iterate Convergence for Uncoupled Learning in Zero-Sum Games with Bandit Feedback Stylistic-STORM (ST-STORM) : Perceiving the Semantic Nature of Appearance Collective Kernel EFT for Pre-activation ResNets PRIM-cipal components analysis One-Shot Generative Flows: Existence and Obstructions Structural interpretability in SVMs with truncated orthogonal polynomial kernels Amortized Optimal Transport from Sliced Potentials MinShap: A Modified Shapley Value Approach for Feature Selection Unsupervised feature selection using Bayesian Tucker decomposition Multi-User mmWave Beam and Rate Adaptation via Combinatorial Satisficing Bandits Best of both worlds: Stochastic & adversarial best-arm identification Scalable Model-Based Clustering with Sequential Monte Carlo Expert-Guided Class-Conditional Goodness-of-Fit Scores for Interpretable Classification with Informative Missingness: An Application to Seismic Monitoring Lightweight Geometric Adaptation for Training Physics-Informed Neural Networks Gating Enables Curvature: A Geometric Expressivity Gap in Attention Zeroth-Order Optimization at the Edge of Stability Differentially Private Conformal Prediction CLion: Efficient Cautious Lion Optimizer with Enhanced Generalization Generative Augmented Inference Improving Machine Learning Performance with Synthetic Augmentation PAC-MCTS: Bias-Aware Pruning for Robust LLM-Guided Search and Planning Path-Sampled Integrated Gradients Heat and Matérn Kernels on Matchings Doubly Outlier-Robust Online Infinite Hidden Markov Model Momentum Further Constrains Sharpness at the Edge of Stochastic Stability Multistage Conditional Compositional Optimization BOAT: Navigating the Sea of In Silico Predictors for Antibody Design via Multi-Objective Bayesian Optimization
A Message Passing Neural Network Surrogate Model for Bond...
Xuan Hu, Qijun Chen, Nicholas H. Luo, Richy J. Zheng, Shaofan Li · 2024-10-30 · via stat.ML updates on arXiv.org

Peridynamics is a non-local continuum mechanics theory that offers unique advantages for modeling problems involving discontinuities and complex deformations. Within the peridynamic framework, various formulations exist, among which the material correspondence formulation stands out for its ability to directly incorporate traditional continuum material models, making it highly applicable to a range of engineering challenges. A notable advancement in this area is the bond-associated correspondence model, which not only resolves issues of material instability but also achieves high computational accuracy. However, the bond-associated model typically requires higher computational costs than FEA, which can limit its practical application. To address this computational challenge, we propose a novel surrogate model based on a message-passing neural network (MPNN) specifically designed for the bond-associated peridynamic material correspondence formulation. Leveraging the similarities between graph structure and the neighborhood connectivity inherent to peridynamics, we construct an MPNN that can transfers domain knowledge from peridynamics into a computational graph and shorten the computation time via GPU acceleration. Unlike conventional graph neural networks that focus on node features, our model emphasizes edge-based features, capturing the essential material point interactions in the formulation. A key advantage of this neural network approach is its flexibility: it does not require fixed neighborhood connectivity, making it adaptable across diverse configurations and scalable for complex systems. Furthermore, the model inherently possesses translational and rotational invariance, enabling it to maintain physical objectivity: a critical requirement for accurate mechanical modeling.