Language-encoded network topology enables large language models to reason about complex networks
Authors: Ucchwas Talukder Utsha, Sakib Mostafa, James Zou, Md Tauhidul Islam
Organizations: Department of Radiation Oncology, Stanford University, Stanford, California, USA · Department of Electrical Engineering, Stanford University, Stanford, California, USA · Department of Biomedical Data Science, Stanford University School of Medicine, Stanford, California, USA · Department of Computer Science, Stanford University, Stanford, California, USA
Networks describe systems in biology and beyond, from protein interactions and social relationships to power grids and citation records. Reasoning about such systems requires understanding their structure: which elements are central, which connections bridge separate communities, and how it changes when elements are removed. Although large language models (LLMs) excel at natural language, they struggle with such questions when networks are given as edge lists, sentences or measurement tables, because their structural meaning must be inferred. Here we introduce BioGlyph, which compiles network topology into an interpretable and transferable language of structural roles. BioGlyph combines graph partitioning and structural measurements to identify roles such as hubs, community cores and cross-community connectors, and fixed rules to translate them into a universal vocabulary. The representation describes each element through its structural role, supporting evidence and semantic consequences, leaving both the network and the LLM unchanged. Across twenty networks spanning five domains, BioGlyph substantially improves open LLMs' ability to answer structural reasoning questions, outperforming edge-based, numerical and learned representations by up to 26 percentage points in system accuracy. Ablations show that the gain comes from explicitly encoding structural roles in semantically interpretable terms. The gain is more prominent in dense, community-structured networks and diminishes in sparse networks whose topology is more readily inferred from text. In a budding-yeast protein-interaction network, BioGlyph exposes biological organization: cross-community connectors are enriched for essential genes, whereas peripheral proteins are depleted. BioGlyph thus provides an interpretable representation for both language models and scientists to reason about network structure.
Graph Language Models (GLMs) have become a promising direction for adapting Large Language Models (LLMs) to graph learning tasks. By transforming graph topology and node information into graph tokens, GLMs allow LLMs to jointly process structured graph inputs and textual instructions. Yet, it remains unclear how LLMs internally interpret these graph tokens and whether graph tokens act as meaningful carriers of graph structure. In this work, we analyze how LLMs process graph information through graph-token behavior in representative GLM architectures. Findings. We find that the internal saliency of graph tokens in GLMs is not equivalent to graph information utilization. Graph sink tokens consistently emerge as activation-level outliers: they can be identified by massive activation values along a small set of hidden-state dimensions and are biased toward early graph-token positions. However, this activation-level saliency does not imply that these tokens are the main carriers of graph information. Unlike classical attention sinks in language and vision-language models, graph sink tokens do not necessarily attract the largest attention weights from query tokens. Through pruning, repositioning, and swapping interventions, we show that graph sink tokens are not the most important semantic or structural tokens for downstream prediction. Implications. Together, these results suggest that after current GLMs map graph structure into the LLM token space, the resulting graph-token representations do not naturally form a fully usable topology-aware internal representation; instead, they exhibit a decoupling between activation-level saliency and graph-semantic utility. This decoupling points to limitations in existing graph-token construction, placement, and alignment mechanisms.
Large Language Models (LLMs) show remarkable semantic understanding but often struggle with structural understanding when processing graph topologies in a serialized format. Existing solutions rely on training external graph-based adapters or fine-tuning, which incur high costs and lost generalizability. In this work, we investigate the internal mechanisms of LLMs and present a critical finding: LLMs spontaneously reconstruct the graph's topology internally, evidenced by a distinct "sawtooth" pattern in their attention maps that structurally aligns with the "token-level adjacency matrix". However, this intrinsic structural understanding is diluted by the attention sink. We theoretically formalize this dilution as a representation bottleneck, stemming from a fundamental conflict: the model's anisotropic bias, essential for language tasks, suppresses the topology-aware local aggregation required for graph reasoning. To address this, we propose a training-free solution, named StructuraL Attention SHarpening (SLASH), which amplifies this internal structural understanding via a plug-and-play attention redistribution. Experiments on pure graph tasks and molecular prediction validate that SLASH delivers significant and consistent performance gains across diverse LLMs.
Large language models are increasingly used as natural-language interfaces to structured data, yet they remain unreliable when answers require consistent evidence conditioning, dependency-aware reasoning, and uncertainty estimation. Bayesian networks provide an explicit probabilistic reasoning layer, but learning useful structures from data remains costly and fragile at scale. We introduce ABSOL, a hybrid LLM-guided Bayesian network structure-learning framework that uses LLMs as bounded semantic guides. Across five discrete BN benchmarks spanning 27 to 1041 nodes, ABSOL is the only evaluated method to produce a viable graph on every benchmark, and achieves the highest Edge F_1 on every benchmark larger than 27 nodes with GPT-5.4. The four LLM augmentations, which contribute complementary semantic evidence to the statistical backbone, improve Edge F_1 over the non-LLM aggregation backbone by +0.23 on average. Complementary post-hoc refinement experiments suggest that these gains depend in part on limiting the LLM's authority over the final structure. Together, these results show that language-derived semantic knowledge can substantially improve scalable probabilistic structure learning when used as bounded guidance within a statistically grounded reasoning pipeline. The code for ABSOL is available at github.com/megagonlabs/absol-bn.