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Making Room for AI: Multi-GPU Molecular Dynamics with Deep Potentials in GROMACS

arXiv:2604.07276v1 Announce Type: cross Abstract: GROMACS is a de-facto standard for classical Molecular Dynamics (MD). The rise of AI-driven interatomic potentials that pursue near-quantum accuracy at MD throughput now poses a significant challenge: embedding neural-network inference into multi-GPU simulations retaining…

Fast Spatial Memory with Elastic Test-Time Training

arXiv:2604.07350v1 Announce Type: cross Abstract: Large Chunk Test-Time Training (LaCT) has shown strong performance on long-context 3D reconstruction, but its fully plastic inference-time updates remain vulnerable to catastrophic forgetting and overfitting. As a result, LaCT is typically instantiated with a…

Quality-preserving Model for Electronics Production Quality Tests Reduction

arXiv:2604.06451v1 Announce Type: new Abstract: Manufacturing test flows in high-volume electronics production are typically fixed during product development and executed unchanged on every unit, even as failure patterns and process conditions evolve. This protects quality, but it also imposes unnecessary…

Weighted Bayesian Conformal Prediction

arXiv:2604.06464v1 Announce Type: new Abstract: Conformal prediction provides distribution-free prediction intervals with finite-sample coverage guarantees, and recent work by Snell & Griffiths reframes it as Bayesian Quadrature (BQ-CP), yielding powerful data-conditional guarantees via Dirichlet posteriors over thresholds. However, BQ-CP fundamentally…

In-Context Decision Making for Optimizing Complex AutoML Pipelines

arXiv:2508.13657v2 Announce Type: replace Abstract: Combined Algorithm Selection and Hyperparameter Optimization (CASH) has been fundamental to traditional AutoML systems. However, with the advancements of pre-trained models, modern ML workflows go beyond hyperparameter optimization and often require fine-tuning, ensembling, and other…