Graph Neural Architecture Search (GNAS) facilitates the automatic design of Graph Neural Networks (GNNs) tailored to specific downstream graph learning tasks. However, existing GNAS approaches often require manual adaptation to new graph search spaces, necessitating substantial code optimization and domain-specific knowledge. To address this challenge, we present LLM4GNAS, a toolkit for GNAS that leverages the generative capabilities of Large Language Models (LLMs). LLM4GNAS includes an algorithm library for graph neural architecture search algorithms based on LLMs, enabling the adaptation of GNAS methods to new search spaces through the modification of LLM prompts. This approach reduces the need for manual intervention in algorithm adaptation and code modification. The LLM4GNAS toolkit is extensible and robust, incorporating LLM-enhanced graph feature engineering, LLM-enhanced graph neural architecture search, and LLM-enhanced hyperparameter optimization. Experimental results indicate that LLM4GNAS outperforms existing GNAS methods on tasks involving both homogeneous and heterogeneous graphs.

We develop a graph neural network (GNN) to compute, within a time budget of 1 to 2 milliseconds required by practical systems, the optimal linear precoder (OLP) maximizing the minimal downlink user data rate for a Cell-Free Massive MIMO system - a key 6G wireless technology. The state-of-the-art method is a bisection search on second order cone programming feasibility test (B-SOCP) which is a magnitude too slow for practical systems. Our approach relies on representing OLP as a node-level prediction task on a graph. We construct a graph that accurately captures the interdependence relation between access points (APs) and user equipments (UEs), and the permutation equivariance of the Max-Min problem. Our neural network, named OLP-GNN, is trained on data obtained by B-SOCP. We tailor the OLP-GNN size, together with several artful data preprocessing and postprocessing methods to meet the runtime requirement. We show by extensive simulations that it achieves near optimal spectral efficiency in a range of scenarios with different number of APs and UEs, and for both line-of-sight and non-line-of-sight radio propagation environments.

Visual Speech Recognition (VSR) tasks are generally recognized to have a lower theoretical performance ceiling than Automatic Speech Recognition (ASR), owing to the inherent limitations of conveying semantic information visually. To mitigate this challenge, this paper introduces an advanced knowledge distillation approach using a Joint-Embedding Predictive Architecture (JEPA), named JEP-KD, designed to more effectively utilize audio features during model training. Central to JEP-KD is the inclusion of a generative network within the embedding layer, which enhances the video encoder's capacity for semantic feature extraction and brings it into closer alignment with the audio features from a pre-trained ASR model's encoder. This approach aims to progressively reduce the performance gap between VSR and ASR. Moreover, a comprehensive multimodal, multistage training regimen for the JEP-KD framework is established, bolstering the robustness and efficacy of the training process. Experiment results demonstrate that JEP-KD significantly improves the performance of VSR models and demonstrates versatility across different VSR platforms, indicating its potential for broader application within other multimodal tasks.

Heterogeneous graph neural architecture search (HGNAS) represents a powerful tool for automatically designing effective heterogeneous graph neural networks. However, existing HGNAS algorithms suffer from inefficient searches and unstable results. In this paper, we present a new GPT-4 based HGNAS model to improve the search efficiency and search accuracy of HGNAS. Specifically, we present a new GPT-4 enhanced Heterogeneous Graph Neural Architecture Search (GHGNAS for short). The basic idea of GHGNAS is to design a set of prompts that can guide GPT-4 toward the task of generating new heterogeneous graph neural architectures. By iteratively asking GPT-4 with the prompts, GHGNAS continually validates the accuracy of the generated HGNNs and uses the feedback to further optimize the prompts. Experimental results show that GHGNAS can design new HGNNs by leveraging the powerful generalization capability of GPT-4. Moreover, GHGNAS runs more effectively and stably than previous HGNAS models based on reinforcement learning and differentiable search algorithms.

Out-of-distribution (OOD) inputs can compromise the performance and safety of real world machine learning systems. While many methods exist for OOD detection and work well on small scale datasets with lower resolution and few classes, few methods have been developed for large-scale OOD detection. Existing large-scale methods generally depend on maximum classification probability, such as the state-of-the-art grouped softmax method. In this work, we develop a novel approach that calculates the probability of the predicted class label based on label distributions learned during the training process. Our method performs better than current state-of-the-art methods with only a negligible increase in compute cost. We evaluate our method against contemporary methods across $14$ datasets and achieve a statistically significant improvement with respect to AUROC (84.2 vs 82.4) and AUPR (96.2 vs 93.7).

Graph Neural Networks (GNNs) have been popularly used for analyzing non-Euclidean data such as social network data and biological data. Despite their success, the design of graph neural networks requires a lot of manual work and domain knowledge. In this paper, we propose a Graph Neural Architecture Search method (GraphNAS for short) that enables automatic search of the best graph neural architecture based on reinforcement learning. Specifically, GraphNAS first uses a recurrent network to generate variable-length strings that describe the architectures of graph neural networks, and then trains the recurrent network with reinforcement learning to maximize the expected accuracy of the generated architectures on a validation data set. Extensive experimental results on node classification tasks in both transductive and inductive learning settings demonstrate that GraphNAS can achieve consistently better performance on the Cora, Citeseer, Pubmed citation network, and protein-protein interaction network. On node classification tasks, GraphNAS can design a novel network architecture that rivals the best human-invented architecture in terms of test set accuracy.