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GL-LFGNN:A Global-Local Dual-branch Causal Graph Neural Network Based on Liang-Kleeman Information Flow for EEG Emotion Recognition

arXiv:2605.25061v1 Announce Type: cross Abstract: EEG-based emotion recognition holds significant promise for objective diagnosis of mood disorders. Graph neural networks (GNNs) have emerged as the dominant paradigm for modeling inter-channel dependencies in EEG, yet existing approaches rely on symmetric adjacency matrices derived from spatial proximity or functional correlations that fundamentally capture statistical associations rather than directed causal influences, which conflicts with the inherently asymmetric, causally-driven nature of neural information flow. To bridge this gap, we propose GL-LFGNN, a Global-Local Dual-branch Causal Graph Neural Network grounded in Liang-Kleeman information flow theory. Unlike Granger causality that merely assesses temporal precedence, our approach rigorously quantifies causal strength from a dynamical systems perspective, yielding neurophysiologically interpretable directed graphs. A dual-branch architecture further integrates whole-brain connectivity with region-specific processing aligned to established functional neuroanatomy. On the MEEG dataset, GL-LFGNN achieves 86.17% (Arousal) and 86.71% (Valence) accuracy with only 37K parameters -- approximately 10% of the current state-of-the-art -- demonstrating that principled causal modeling can simultaneously enhance interpretability, generalization, and computational efficiency. Code will be released.
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Unified modeling of 3D molecular generation via atomic interactions with PocketXMol

A versatile, atom-level generative AI model enables unified pocket-interacting tasks, from docking to de novo design, and demonstrates robust experimental validation for both small-molecule and peptide therapeutics.
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Generalized Discrete Diffusion with Self-Correction

arXiv:2603.02230v1 Announce Type: cross Abstract: Self-correction is an effective technique for maintaining parallel sampling in discrete diffusion models with minimal performance degradation. Prior work has explored self-correction at inference time or during post-training; however, such approaches often suffer from limited generalization and may impair reasoning performance. GIDD pioneers pretraining-based self-correction via a multi-step BERT-style uniform-absorbing objective. However, GIDD relies on a continuous interpolation-based pipeline with opaque interactions between uniform transitions and absorbing masks, which complicates hyperparameter tuning and hinders practical performance. In this work, we propose a Self-Correcting Discrete Diffusion (SCDD) model to reformulate pretrained self-correction with explicit state transitions and learn directly in discrete time. Our framework also simplifies the training noise schedule, eliminates a redundant remasking step, and relies exclusively on uniform transitions to learn self-correction. Experiments at the GPT-2 scale demonstrate that our method enables more efficient parallel decoding while preserving generation quality.
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Adaptive Runge-Kutta Dynamics for Spatiotemporal Prediction

arXiv:2405.14504v2 Announce Type: replace-cross Abstract: Spatiotemporal prediction is important in solving natural problems and processing video frames, especially in weather forecasting and human action recognition. Recent advances attempt to incorporate prior physical knowledge into the deep learning framework to estimate the unknown governing partial differential equations (PDEs) in complex dynamics, which have shown promising results in spatiotemporal prediction tasks. However, previous approaches only restrict neural network architectures or loss functions to acquire physical or PDE features, which decreases the representative capacity of a neural network. Meanwhile, the updating process of the physical state cannot be effectively estimated. To solve the problems mentioned above, we introduce a physical-guided neural network, which utilizes an adaptive second-order Runge-Kutta method with physical constraints to model the physical states more precisely. Furthermore, we propose a frequency-enhanced Fourier module to strengthen the model's ability to estimate the spatiotemporal dynamics. We evaluate our model on both spatiotemporal and video prediction tasks. The experimental results show that our model outperforms several state-of-the-art methods and performs the best in several spatiotemporal scenarios with a much smaller parameter count.
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