Abstract:Recent studies show that LLMs, particularly open-source models, struggle to follow complex instructions with multiple constraints. Despite the importance, methods to improve LLMs' adherence to such constraints remain unexplored, and current research focuses on evaluating this ability rather than developing solutions. While a few studies enhance constraint adherence through model tuning, this approach is computationally expensive and heavily reliant on training data quality. An alternative is to leverage LLMs' self-correction capabilities, allowing them to adjust responses to better meet specified constraints. However, this self-correction ability of LLMs is limited by the feedback quality, as LLMs cannot autonomously generate reliable feedback or detect errors. Moreover, the self-refinement process heavily depends on few-shot examples that illustrate how to modify responses to meet constraints. As constraints in complex instructions are diverse and vary widely, manually crafting few-shot examples for each constraint type can be labor-intensive and sub-optimal. To deal with these two challenges, we propose the Divide-Verify-Refine (DVR) framework with three steps: (1) Divide complex instructions into single constraints and prepare appropriate tools; (2) Verify: To address the feedback quality problem, these tools will rigorously verify responses and provide reliable feedback; (3) Refine: To address the constraint diversity challenge, we design a refinement repository that collects successful refinement processes and uses them as few-shot demonstrations for future cases, allowing LLMs to learn from the past experience during inference. Additionally, we develop a new dataset of complex instructions, each containing 1-6 constraints. Experiments show that the framework significantly improves performance, doubling LLama3.1-8B's constraint adherence on instructions with 6 constraints.
Abstract:Graph-structured data is prevalent in the real world. Recently, due to the powerful emergent capabilities, Large Language Models (LLMs) have shown promising performance in modeling graphs. The key to effectively applying LLMs on graphs is converting graph data into a format LLMs can comprehend. Graph-to-token approaches are popular in enabling LLMs to process graph information. They transform graphs into sequences of tokens and align them with text tokens through instruction tuning, where self-supervised instruction tuning helps LLMs acquire general knowledge about graphs, and supervised fine-tuning specializes LLMs for the downstream tasks on graphs. Despite their initial success, we find that existing methods have a misalignment between self-supervised tasks and supervised downstream tasks, resulting in negative transfer from self-supervised fine-tuning to downstream tasks. To address these issues, we propose Graph Alignment Large Language Models (GALLM) to benefit from aligned task templates. In the self-supervised tuning stage, we introduce a novel text matching task using templates aligned with downstream tasks. In the task-specific tuning stage, we propose two category prompt methods that learn supervision information from additional explanation with further aligned templates. Experimental evaluations on four datasets demonstrate substantial improvements in supervised learning, multi-dataset generalizability, and particularly in zero-shot capability, highlighting the model's potential as a graph foundation model.
Abstract:In this paper, we investigate Extractive Question Answering (EQA) with Large Language Models (LLMs) under domain drift, i.e., can LLMs generalize well to closed-domains that require specific knowledge such as medicine and law in a zero-shot fashion without additional in-domain training? To this end, we devise a series of experiments to empirically explain the performance gap. Our findings suggest that: a) LLMs struggle with dataset demands of closed-domains such as retrieving long answer-spans; b) Certain LLMs, despite showing strong overall performance, display weaknesses in meeting basic requirements as discriminating between domain-specific senses of words which we link to pre-processing decisions; c) Scaling model parameters is not always effective for cross-domain generalization; and d) Closed-domain datasets are quantitatively much different than open-domain EQA datasets and current LLMs struggle to deal with them. Our findings point out important directions for improving existing LLMs.
Abstract:As deep vision models' popularity rapidly increases, there is a growing emphasis on explanations for model predictions. The inherently explainable attribution method aims to enhance the understanding of model behavior by identifying the important regions in images that significantly contribute to predictions. It is achieved by cooperatively training a selector (generating an attribution map to identify important features) and a predictor (making predictions using the identified features). Despite many advancements, existing methods suffer from the incompleteness problem, where discriminative features are masked out, and the interlocking problem, where the non-optimized selector initially selects noise, causing the predictor to fit on this noise and perpetuate the cycle. To address these problems, we introduce a new objective that discourages the presence of discriminative features in the masked-out regions thus enhancing the comprehensiveness of feature selection. A pre-trained detector is introduced to detect discriminative features in the masked-out region. If the selector selects noise instead of discriminative features, the detector can observe and break the interlocking situation by penalizing the selector. Extensive experiments show that our model makes accurate predictions with higher accuracy than the regular black-box model, and produces attribution maps with high feature coverage, localization ability, fidelity and robustness. Our code will be available at \href{https://github.com/Zood123/COMET}{https://github.com/Zood123/COMET}.
Abstract:Graph self-training (GST), which selects and assigns pseudo-labels to unlabeled nodes, is popular for tackling label sparsity in graphs. However, recent study on homophily graphs show that GST methods could introduce and amplify distribution shift between training and test nodes as they tend to assign pseudo-labels to nodes they are good at. As GNNs typically perform better on homophilic nodes, there could be potential shifts towards homophilic pseudo-nodes, which is underexplored. Our preliminary experiments on heterophilic graphs verify that these methods can cause shifts in homophily ratio distributions, leading to \textit{training bias} that improves performance on homophilic nodes while degrading it on heterophilic ones. Therefore, we study a novel problem of reducing homophily ratio distribution shifts during self-training on heterophilic graphs. A key challenge is the accurate calculation of homophily ratios and their distributions without extensive labeled data. To tackle them, we propose a novel Heterophily-aware Distribution Consistency-based Graph Self-Training (HC-GST) framework, which estimates homophily ratios using soft labels and optimizes a selection vector to align pseudo-nodes with the global homophily ratio distribution. Extensive experiments on both homophilic and heterophilic graphs show that HC-GST effectively reduces training bias and enhances self-training performance.
Abstract:Graphs have emerged as critical data structures for content analysis in various domains, such as social network analysis, bioinformatics, and recommendation systems. Node classification, a fundamental task in this context, is typically tackled using graph neural networks (GNNs). Unfortunately, conventional GNNs still face challenges in scenarios with few labeled nodes, despite the prevalence of few-shot node classification tasks in real-world applications. To address this challenge, various approaches have been proposed, including graph meta-learning, transfer learning, and methods based on Large Language Models (LLMs). However, traditional meta-learning and transfer learning methods often require prior knowledge from base classes or fail to exploit the potential advantages of unlabeled nodes. Meanwhile, LLM-based methods may overlook the zero-shot capabilities of LLMs and rely heavily on the quality of generated contexts. In this paper, we propose a novel approach that integrates LLMs and GNNs, leveraging the zero-shot inference and reasoning capabilities of LLMs and employing a Graph-LLM-based active learning paradigm to enhance GNNs' performance. Extensive experiments demonstrate the effectiveness of our model in improving node classification accuracy with considerably limited labeled data, surpassing state-of-the-art baselines by significant margins.
Abstract:Graph Neural Networks (GNNs) have achieved promising results in tasks such as node classification and graph classification. However, recent studies reveal that GNNs are vulnerable to backdoor attacks, posing a significant threat to their real-world adoption. Despite initial efforts to defend against specific graph backdoor attacks, there is no work on defending against various types of backdoor attacks where generated triggers have different properties. Hence, we first empirically verify that prediction variance under edge dropping is a crucial indicator for identifying poisoned nodes. With this observation, we propose using random edge dropping to detect backdoors and theoretically show that it can efficiently distinguish poisoned nodes from clean ones. Furthermore, we introduce a novel robust training strategy to efficiently counteract the impact of the triggers. Extensive experiments on real-world datasets show that our framework can effectively identify poisoned nodes, significantly degrade the attack success rate, and maintain clean accuracy when defending against various types of graph backdoor attacks with different properties.
Abstract:Recent progress in Graph Neural Networks (GNNs) has greatly enhanced the ability to model complex molecular structures for predicting properties. Nevertheless, molecular data encompasses more than just graph structures, including textual and visual information that GNNs do not handle well. To bridge this gap, we present an innovative framework that utilizes multimodal molecular data to extract insights from Large Language Models (LLMs). We introduce GALLON (Graph Learning from Large Language Model Distillation), a framework that synergizes the capabilities of LLMs and GNNs by distilling multimodal knowledge into a unified Multilayer Perceptron (MLP). This method integrates the rich textual and visual data of molecules with the structural analysis power of GNNs. Extensive experiments reveal that our distilled MLP model notably improves the accuracy and efficiency of molecular property predictions.
Abstract:Graph Neural Networks (GNNs) have shown remarkable performance in various tasks. However, recent works reveal that GNNs are vulnerable to backdoor attacks. Generally, backdoor attack poisons the graph by attaching backdoor triggers and the target class label to a set of nodes in the training graph. A GNN trained on the poisoned graph will then be misled to predict test nodes attached with trigger to the target class. Despite their effectiveness, our empirical analysis shows that triggers generated by existing methods tend to be out-of-distribution (OOD), which significantly differ from the clean data. Hence, these injected triggers can be easily detected and pruned with widely used outlier detection methods in real-world applications. Therefore, in this paper, we study a novel problem of unnoticeable graph backdoor attacks with in-distribution (ID) triggers. To generate ID triggers, we introduce an OOD detector in conjunction with an adversarial learning strategy to generate the attributes of the triggers within distribution. To ensure a high attack success rate with ID triggers, we introduce novel modules designed to enhance trigger memorization by the victim model trained on poisoned graph. Extensive experiments on real-world datasets demonstrate the effectiveness of the proposed method in generating in distribution triggers that can by-pass various defense strategies while maintaining a high attack success rate.
Abstract:Large language models (LLMs), while exhibiting exceptional performance, suffer from hallucinations, especially on knowledge-intensive tasks. Existing works propose to augment LLMs with individual text units retrieved from external knowledge corpora to alleviate the issue. However, in many domains, texts are interconnected (e.g., academic papers in a bibliographic graph are linked by citations and co-authorships) which form a (text-attributed) graph. The knowledge in such graphs is encoded not only in single texts/nodes but also in their associated connections. To facilitate the research of augmenting LLMs with graphs, we manually construct a Graph Reasoning Benchmark dataset called GRBench, containing 1,740 questions that can be answered with the knowledge from 10 domain graphs. Then, we propose a simple and effective framework called Graph Chain-of-thought (Graph-CoT) to augment LLMs with graphs by encouraging LLMs to reason on the graph iteratively. Each Graph-CoT iteration consists of three sub-steps: LLM reasoning, LLM-graph interaction, and graph execution. We conduct systematic experiments with three LLM backbones on GRBench, where Graph-CoT outperforms the baselines consistently. The code is available at https://github.com/PeterGriffinJin/Graph-CoT.