The primary aim of Knowledge Graph embeddings (KGE) is to learn low-dimensional representations of entities and relations for predicting missing facts. While rotation-based methods like RotatE and QuatE perform well in KGE, they face two challenges: limited model flexibility requiring proportional increases in relation size with entity dimension, and difficulties in generalizing the model for higher-dimensional rotations. To address these issues, we introduce OrthogonalE, a novel KGE model employing matrices for entities and block-diagonal orthogonal matrices with Riemannian optimization for relations. This approach enhances the generality and flexibility of KGE models. The experimental results indicate that our new KGE model, OrthogonalE, is both general and flexible, significantly outperforming state-of-the-art KGE models while substantially reducing the number of relation parameters.

Graph Neural Networks (GNNs) have achieved great success in Knowledge Graph Completion (KGC) by modelling how entities and relations interact in recent years. However, the explanation of the predicted facts has not caught the necessary attention. Proper explanations for the results of GNN-based KGC models increase model transparency and help researchers develop more reliable models. Existing practices for explaining KGC tasks rely on instance/subgraph-based approaches, while in some scenarios, paths can provide more user-friendly and interpretable explanations. Nonetheless, the methods for generating path-based explanations for KGs have not been well-explored. To address this gap, we propose Power-Link, the first path-based KGC explainer that explores GNN-based models. We design a novel simplified graph-powering technique, which enables the generation of path-based explanations with a fully parallelisable and memory-efficient training scheme. We further introduce three new metrics for quantitative evaluation of the explanations, together with a qualitative human evaluation. Extensive experiments demonstrate that Power-Link outperforms the SOTA baselines in interpretability, efficiency, and scalability.

Temporal Knowledge Graph (TKG) is an extension of regular knowledge graph by attaching the time scope. Existing temporal knowledge graph question answering (TKGQA) models solely approach simple questions, owing to the prior assumption that each question only contains a single temporal fact with explicit/implicit temporal constraints. Hence, they perform poorly on questions which own multiple temporal facts. In this paper, we propose \textbf{\underline{J}}oint \textbf{\underline{M}}ulti \textbf{\underline{F}}acts \textbf{\underline{R}}easoning \textbf{\underline{N}}etwork (JMFRN), to jointly reasoning multiple temporal facts for accurately answering \emph{complex} temporal questions. Specifically, JMFRN first retrieves question-related temporal facts from TKG for each entity of the given complex question. For joint reasoning, we design two different attention (\ie entity-aware and time-aware) modules, which are suitable for universal settings, to aggregate entities and timestamps information of retrieved facts. Moreover, to filter incorrect type answers, we introduce an additional answer type discrimination task. Extensive experiments demonstrate our proposed method significantly outperforms the state-of-art on the well-known complex temporal question benchmark TimeQuestions.

Question Answering over Knowledge Graph (KGQA) aims to seek answer entities for the natural language question from a large-scale Knowledge Graph~(KG). To better perform reasoning on KG, recent work typically adopts a pre-trained language model~(PLM) to model the question, and a graph neural network~(GNN) based module to perform multi-hop reasoning on the KG. Despite the effectiveness, due to the divergence in model architecture, the PLM and GNN are not closely integrated, limiting the knowledge sharing and fine-grained feature interactions. To solve it, we aim to simplify the above two-module approach, and develop a more capable PLM that can directly support subgraph reasoning for KGQA, namely ReasoningLM. In our approach, we propose a subgraph-aware self-attention mechanism to imitate the GNN for performing structured reasoning, and also adopt an adaptation tuning strategy to adapt the model parameters with 20,000 subgraphs with synthesized questions. After adaptation, the PLM can be parameter-efficient fine-tuned on downstream tasks. Experiments show that ReasoningLM surpasses state-of-the-art models by a large margin, even with fewer updated parameters and less training data. Our codes and data are publicly available at~\url{https://github.com/RUCAIBox/ReasoningLM}.

Conversational recommender systems (CRS) utilize natural language interactions and dialogue history to infer user preferences and provide accurate recommendations. Due to the limited conversation context and background knowledge, existing CRSs rely on external sources such as knowledge graphs to enrich the context and model entities based on their inter-relations. However, these methods ignore the rich intrinsic information within entities. To address this, we introduce the Knowledge-Enhanced Entity Representation Learning (KERL) framework, which leverages both the knowledge graph and a pre-trained language model to improve the semantic understanding of entities for CRS. In our KERL framework, entity textual descriptions are encoded via a pre-trained language model, while a knowledge graph helps reinforce the representation of these entities. We also employ positional encoding to effectively capture the temporal information of entities in a conversation. The enhanced entity representation is then used to develop a recommender component that fuses both entity and contextual representations for more informed recommendations, as well as a dialogue component that generates informative entity-related information in the response text. A high-quality knowledge graph with aligned entity descriptions is constructed to facilitate our study, namely the Wiki Movie Knowledge Graph (WikiMKG). The experimental results show that KERL achieves state-of-the-art results in both recommendation and response generation tasks.

Temporal knowledge graphs represent temporal facts $(s,p,o,\tau)$ relating a subject $s$ and an object $o$ via a relation label $p$ at time $\tau$, where $\tau$ could be a time point or time interval. Temporal knowledge graphs may exhibit static temporal patterns at distinct points in time and dynamic temporal patterns between different timestamps. In order to learn a rich set of static and dynamic temporal patterns and apply them for inference, several embedding approaches have been suggested in the literature. However, as most of them resort to single underlying embedding spaces, their capability to model all kinds of temporal patterns was severely limited by having to adhere to the geometric property of their one embedding space. We lift this limitation by an embedding approach that maps temporal facts into a product space of several heterogeneous geometric subspaces with distinct geometric properties, i.e.\ Complex, Dual, and Split-complex spaces. In addition, we propose a temporal-geometric attention mechanism to integrate information from different geometric subspaces conveniently according to the captured relational and temporal information. Experimental results on standard temporal benchmark datasets favorably evaluate our approach against state-of-the-art models.

The effective analysis of high-dimensional Electronic Health Record (EHR) data, with substantial potential for healthcare research, presents notable methodological challenges. Employing predictive modeling guided by a knowledge graph (KG), which enables efficient feature selection, can enhance both statistical efficiency and interpretability. While various methods have emerged for constructing KGs, existing techniques often lack statistical certainty concerning the presence of links between entities, especially in scenarios where the utilization of patient-level EHR data is limited due to privacy concerns. In this paper, we propose the first inferential framework for deriving a sparse KG with statistical guarantee based on the dynamic log-linear topic model proposed by \cite{arora2016latent}. Within this model, the KG embeddings are estimated by performing singular value decomposition on the empirical pointwise mutual information matrix, offering a scalable solution. We then establish entrywise asymptotic normality for the KG low-rank estimator, enabling the recovery of sparse graph edges with controlled type I error. Our work uniquely addresses the under-explored domain of statistical inference about non-linear statistics under the low-rank temporal dependent models, a critical gap in existing research. We validate our approach through extensive simulation studies and then apply the method to real-world EHR data in constructing clinical KGs and generating clinical feature embeddings.

Recent advances in natural language processing (NLP) owe their success to pre-training language models on large amounts of unstructured data. Still, there is an increasing effort to combine the unstructured nature of LMs with structured knowledge and reasoning. Particularly in the rapidly evolving field of biomedical NLP, knowledge-enhanced language models (KELMs) have emerged as promising tools to bridge the gap between large language models and domain-specific knowledge, considering the available biomedical knowledge graphs (KGs) curated by experts over the decades. In this paper, we develop an approach that uses lightweight adapter modules to inject structured biomedical knowledge into pre-trained language models (PLMs). We use two large KGs, the biomedical knowledge system UMLS and the novel biochemical ontology OntoChem, with two prominent biomedical PLMs, PubMedBERT and BioLinkBERT. The approach includes partitioning knowledge graphs into smaller subgraphs, fine-tuning adapter modules for each subgraph, and combining the knowledge in a fusion layer. We test the performance on three downstream tasks: document classification,question answering, and natural language inference. We show that our methodology leads to performance improvements in several instances while keeping requirements in computing power low. Finally, we provide a detailed interpretation of the results and report valuable insights for future work.

Aiming to accurately predict missing edges representing relations between entities, which are pervasive in real-world Knowledge Graphs (KGs), relation prediction plays a critical role in enhancing the comprehensiveness and utility of KGs. Recent research focuses on path-based methods due to their inductive and explainable properties. However, these methods face a great challenge when lots of reasoning paths do not form Closed Paths (CPs) in the KG. To address this challenge, we propose Anchoring Path Sentence Transformer (APST) by introducing Anchoring Paths (APs) to alleviate the reliance of CPs. Specifically, we develop a search-based description retrieval method to enrich entity descriptions and an assessment mechanism to evaluate the rationality of APs. APST takes both APs and CPs as the inputs of a unified Sentence Transformer architecture, enabling comprehensive predictions and high-quality explanations. We evaluate APST on three public datasets and achieve state-of-the-art (SOTA) performance in 30 of 36 transductive, inductive, and few-shot experimental settings.

The term life sciences refers to the disciplines that study living organisms and life processes, and include chemistry, biology, medicine, and a range of other related disciplines. Research efforts in life sciences are heavily data-driven, as they produce and consume vast amounts of scientific data, much of which is intrinsically relational and graph-structured. The volume of data and the complexity of scientific concepts and relations referred to therein promote the application of advanced knowledge-driven technologies for managing and interpreting data, with the ultimate aim to advance scientific discovery. In this survey and position paper, we discuss recent developments and advances in the use of graph-based technologies in life sciences and set out a vision for how these technologies will impact these fields into the future. We focus on three broad topics: the construction and management of Knowledge Graphs (KGs), the use of KGs and associated technologies in the discovery of new knowledge, and the use of KGs in artificial intelligence applications to support explanations (explainable AI). We select a few exemplary use cases for each topic, discuss the challenges and open research questions within these topics, and conclude with a perspective and outlook that summarizes the overarching challenges and their potential solutions as a guide for future research.