Zaiqiao Meng

Muhammad Arslan Manzoor, Sarah Albarri, Ziting Xian et al. · berkeley

Multimodality Representation Learning, as a technique of learning to embed information from different modalities and their correlations, has achieved remarkable success on a variety of applications, such as Visual Question Answering (VQA), Natural Language for Visual Reasoning (NLVR), and Vision Language Retrieval (VLR). Among these applications, cross-modal interaction and complementary information from different modalities are crucial for advanced models to perform any multimodal task, e.g., understand, recognize, retrieve, or generate optimally. Researchers have proposed diverse methods to address these tasks. The different variants of transformer-based architectures performed extraordinarily on multiple modalities. This survey presents the comprehensive literature on the evolution and enhancement of deep learning multimodal architectures to deal with textual, visual and audio features for diverse cross-modal and modern multimodal tasks. This study summarizes the (i) recent task-specific deep learning methodologies, (ii) the pretraining types and multimodal pretraining objectives, (iii) from state-of-the-art pretrained multimodal approaches to unifying architectures, and (iv) multimodal task categories and possible future improvements that can be devised for better multimodal learning. Moreover, we prepare a dataset section for new researchers that covers most of the benchmarks for pretraining and finetuning. Finally, major challenges, gaps, and potential research topics are explored. A constantly-updated paperlist related to our survey is maintained at https://github.com/marslanm/multimodality-representation-learning.

Yupan Huang, Zaiqiao Meng, Fangyu Liu et al. · cambridge, deepmind

Large language models exhibit enhanced zero-shot performance on various tasks when fine-tuned with instruction-following data. Multimodal instruction-following models extend these capabilities by integrating both text and images. However, existing models such as MiniGPT-4 and LLaVA face challenges in maintaining dialogue coherence in scenarios involving multiple images. A primary reason is the lack of a specialized dataset for this critical application. To bridge these gaps, we introduce SparklesDialogue, the first machine-generated dialogue dataset tailored for word-level interleaved multi-image and text interactions. Furthermore, we construct SparklesEval, a GPT-assisted benchmark for quantitatively assessing a model's conversational competence across multiple images and dialogue turns. We then present SparklesChat, a multimodal instruction-following model for open-ended dialogues across multiple images. Our experiments validate the effectiveness of training SparklesChat with SparklesDialogue based on MiniGPT-4 and LLaVA-v1.5, which enhances comprehension across multiple images and dialogue turns, and does not compromise single-image understanding capabilities. Qualitative evaluations further demonstrate SparklesChat's generality in handling real-world applications. All resources related to this study are publicly available at https://github.com/HYPJUDY/Sparkles.

Guanzheng Chen, Xin Li, Zaiqiao Meng et al.

Transformer-based Large Language Models (LLMs) are pioneering advances in many natural language processing tasks, however, their exceptional capabilities are restricted within the preset context window of Transformer. Position Embedding (PE) scaling methods, while effective in extending the context window to a specific length, demonstrate either notable limitations in their extrapolation abilities or sacrificing partial performance within the context window. Length extrapolation methods, although theoretically capable of extending the context window beyond the training sequence length, often underperform in practical long-context applications. To address these challenges, we propose Continuous Length EXtrapolation (CLEX) for LLMs. We generalise the PE scaling approaches to model the continuous dynamics by ordinary differential equations over the length scaling factor, thereby overcoming the constraints of current PE scaling methods designed for specific lengths. Moreover, by extending the dynamics to desired context lengths beyond the training sequence length, CLEX facilitates the length extrapolation with impressive performance in practical tasks. We demonstrate that CLEX can be seamlessly incorporated into LLMs equipped with Rotary Position Embedding, such as LLaMA and GPT-NeoX, with negligible impact on training and inference latency. Experimental results reveal that CLEX can effectively extend the context window to over 4x or almost 8x training length, with no deterioration in performance. Furthermore, when evaluated on the practical LongBench benchmark, our model trained on a 4k length exhibits competitive performance against state-of-the-art open-source models trained on context lengths up to 32k. Our code is available at https://github.com/DAMO-NLP-SG/CLEX.

Zhangdie Yuan, Songbo Hu, Ivan Vulić et al. · cambridge

Acquiring factual knowledge with Pretrained Language Models (PLMs) has attracted increasing attention, showing promising performance in many knowledge-intensive tasks. Their good performance has led the community to believe that the models do possess a modicum of reasoning competence rather than merely memorising the knowledge. In this paper, we conduct a comprehensive evaluation of the learnable deductive (also known as explicit) reasoning capability of PLMs. Through a series of controlled experiments, we posit two main findings. (i) PLMs inadequately generalise learned logic rules and perform inconsistently against simple adversarial surface form edits. (ii) While the deductive reasoning fine-tuning of PLMs does improve their performance on reasoning over unseen knowledge facts, it results in catastrophically forgetting the previously learnt knowledge. Our main results suggest that PLMs cannot yet perform reliable deductive reasoning, demonstrating the importance of controlled examinations and probing of PLMs' reasoning abilities; we reach beyond (misleading) task performance, revealing that PLMs are still far from human-level reasoning capabilities, even for simple deductive tasks.

Jiahang Cao, Jinyuan Fang, Zaiqiao Meng et al.

Knowledge graph embedding (KGE) is an increasingly popular technique that aims to represent entities and relations of knowledge graphs into low-dimensional semantic spaces for a wide spectrum of applications such as link prediction, knowledge reasoning and knowledge completion. In this paper, we provide a systematic review of existing KGE techniques based on representation spaces. Particularly, we build a fine-grained classification to categorise the models based on three mathematical perspectives of the representation spaces: (1) Algebraic perspective, (2) Geometric perspective, and (3) Analytical perspective. We introduce the rigorous definitions of fundamental mathematical spaces before diving into KGE models and their mathematical properties. We further discuss different KGE methods over the three categories, as well as summarise how spatial advantages work over different embedding needs. By collating the experimental results from downstream tasks, we also explore the advantages of mathematical space in different scenarios and the reasons behind them. We further state some promising research directions from a representation space perspective, with which we hope to inspire researchers to design their KGE models as well as their related applications with more consideration of their mathematical space properties.

Meiru Zhang, Yixuan Su, Zaiqiao Meng et al. · cambridge

Event extraction is a complex information extraction task that involves extracting events from unstructured text. Prior classification-based methods require comprehensive entity annotations for joint training, while newer generation-based methods rely on heuristic templates containing oracle information such as event type, which is often unavailable in real-world scenarios. In this study, we consider a more realistic setting of this task, namely the Oracle-Free Event Extraction (OFEE) task, where only the input context is given without any oracle information, including event type, event ontology and trigger word. To solve this task, we propose a new framework, called COFFEE, which extracts the events solely based on the document context without referring to any oracle information. In particular, a contrastive selection model is introduced in COFFEE to rectify the generated triggers and handle multi-event instances. The proposed COFFEE outperforms state-of-the-art approaches under the oracle-free setting of the event extraction task, as evaluated on a public event extraction benchmark ACE05.

Yu Wang, Xin Xin, Zaiqiao Meng et al.

Learning from corrupted labels is very common in real-world machine-learning applications. Memorizing such noisy labels could affect the learning of the model, leading to sub-optimal performances. In this work, we propose a novel framework to learn robust machine-learning models from noisy labels. Through an empirical study, we find that different models make relatively similar predictions on clean examples, while the predictions on noisy examples vary much more across different models. Motivated by this observation, we propose \em denoising with cross-model agreement \em (DeCA) which aims to minimize the KL-divergence between the true label distributions parameterized by two machine learning models while maximizing the likelihood of data observation. We employ the proposed DeCA on both the binary label scenario and the multiple label scenario. For the binary label scenario, we select implicit feedback recommendation as the downstream task and conduct experiments with four state-of-the-art recommendation models on four datasets. For the multiple-label scenario, the downstream application is image classification on two benchmark datasets. Experimental results demonstrate that the proposed methods significantly improve the model performance compared with normal training and other denoising methods on both binary and multiple-label scenarios.

Xi Zhang, Yingshu Li, Zaiqiao Meng et al.

Radiology report generation (RRG) is commonly formulated as a single-path generation task, where a multimodal large language model (MLLM) produces one decoded report as the final output. While recent progress has largely been driven by scaling training data, model capacity, and retrieval mechanisms, improving report quality at inference time remains underexplored. In this work, we observe that fixed radiology MLLMs often generate clinically stronger reports elsewhere in their candidate pool than the one selected by default decoding, suggesting that inference-time decision making remains an overlooked bottleneck. To address this, we propose Clinical Consensus Selection (CCS), a decoder-agnostic inference-time selection framework that samples multiple candidate reports and selects the one with the highest clinical consensus across the rollout pool. CCS unifies text-based utilities with a radiology-adapted utility computed by an image--report-trained multimodal embedder, which measures candidate agreement beyond surface-level textual similarity. Across three datasets and multiple radiology MLLMs, CCS consistently improves inference-time performance over single-path decoding and generic Best-of-N baselines, with particularly clear gains on clinical metrics. Further analysis shows that image-grounded utility forms a selection axis distinct from textual consensus and that substantial headroom remains for improving RRG at inference time.

Zijun Long, Zaiqiao Meng, Gerardo Aragon Camarasa et al.

Vision Transformers (ViTs) have emerged as popular models in computer vision, demonstrating state-of-the-art performance across various tasks. This success typically follows a two-stage strategy involving pre-training on large-scale datasets using self-supervised signals, such as masked random patches, followed by fine-tuning on task-specific labeled datasets with cross-entropy loss. However, this reliance on cross-entropy loss has been identified as a limiting factor in ViTs, affecting their generalization and transferability to downstream tasks. Addressing this critical challenge, we introduce a novel Label-aware Contrastive Training framework, LaCViT, which significantly enhances the quality of embeddings in ViTs. LaCViT not only addresses the limitations of cross-entropy loss but also facilitates more effective transfer learning across diverse image classification tasks. Our comprehensive experiments on eight standard image classification datasets reveal that LaCViT statistically significantly enhances the performance of three evaluated ViTs by up-to 10.78% under Top-1 Accuracy.

Zijun Long, George Killick, Richard McCreadie et al.

State-of-the-art image models predominantly follow a two-stage strategy: pre-training on large datasets and fine-tuning with cross-entropy loss. Many studies have shown that using cross-entropy can result in sub-optimal generalisation and stability. While the supervised contrastive loss addresses some limitations of cross-entropy loss by focusing on intra-class similarities and inter-class differences, it neglects the importance of hard negative mining. We propose that models will benefit from performance improvement by weighting negative samples based on their dissimilarity to positive counterparts. In this paper, we introduce a new supervised contrastive learning objective, SCHaNe, which incorporates hard negative sampling during the fine-tuning phase. Without requiring specialized architectures, additional data, or extra computational resources, experimental results indicate that SCHaNe outperforms the strong baseline BEiT-3 in Top-1 accuracy across various benchmarks, with significant gains of up to $3.32\%$ in few-shot learning settings and $3.41\%$ in full dataset fine-tuning. Importantly, our proposed objective sets a new state-of-the-art for base models on ImageNet-1k, achieving an 86.14\% accuracy. Furthermore, we demonstrate that the proposed objective yields better embeddings and explains the improved effectiveness observed in our experiments.

Panfeng Cao, Ye Wang, Qiang Zhang et al.

Key information extraction (KIE) from scanned documents has gained increasing attention because of its applications in various domains. Although promising results have been achieved by some recent KIE approaches, they are usually built based on discriminative models, which lack the ability to handle optical character recognition (OCR) errors and require laborious token-level labelling. In this paper, we propose a novel generative end-to-end model, named GenKIE, to address the KIE task. GenKIE is a sequence-to-sequence multimodal generative model that utilizes multimodal encoders to embed visual, layout and textual features and a decoder to generate the desired output. Well-designed prompts are leveraged to incorporate the label semantics as the weakly supervised signals and entice the generation of the key information. One notable advantage of the generative model is that it enables automatic correction of OCR errors. Besides, token-level granular annotation is not required. Extensive experiments on multiple public real-world datasets show that GenKIE effectively generalizes over different types of documents and achieves state-of-the-art results. Our experiments also validate the model's robustness against OCR errors, making GenKIE highly applicable in real-world scenarios.

Andreas Sauter, Yuyue Zhao, Jacopo Urbani et al.

Scientific idea generation is a cornerstone of autonomous knowledge discovery, yet the iterative evolution required to transform initial concepts into high-quality research proposals remains a formidable challenge for Large Language Models (LLMs). Existing Reinforcement Learning (RL) paradigms often rely on rubric-based scalar rewards that provide global quality scores but lack actionable granularity. Conversely, language-based refinement methods are typically confined to inference-time prompting, targeting models that are not explicitly optimized to internalize such critiques. To bridge this gap, we propose \textbf{EvoIdeator}, a framework that facilitates the evolution of scientific ideas by aligning the RL training objective with \textbf{checklist-grounded feedback}. EvoIdeator leverages a structured judge model to generate two synergistic signals: (1) \emph{lexicographic rewards} for multi-dimensional optimization, and (2) \emph{fine-grained language feedback} that offers span-level critiques regarding grounding, feasibility, and methodological rigor. By integrating these signals into the RL loop, we condition the policy to systematically utilize precise feedback during both optimization and inference. Extensive experiments demonstrate that EvoIdeator, built on Qwen3-4B, significantly outperforms much larger frontier models across key scientific metrics. Crucially, the learned policy exhibits strong generalization to diverse external feedback sources without further fine-tuning, offering a scalable and rigorous path toward self-refining autonomous ideation.

Zhaohan Meng, Zhen Bai, Ke Yuan et al.

Protein-ligand modeling underpins computational drug discovery and molecular design. Existing protein-ligand benchmarks typically evaluate whether a protein and ligand interact and how strongly they bind, through tasks such as binary binding prediction and affinity regression. However, these evaluations provide limited evidence of whether models can localize binding sites or identify the non-covalent interactions underlying molecular recognition. To address this gap, we introduce InteractBind, a large-scale protein-ligand dataset comprising approximately 100k protein-ligand pairs, together with a benchmark for fine-grained evaluation. The core fine-grained task is that of binding-site localization, which uses protein-residue and ligand-atom interaction maps spanning six major types of non-covalent interactions to assess whether model-derived interaction maps localize binding sites. InteractBind further includes binding affinity and protein similarity-controlled splits to support realistic generalization assessment. Using InteractBind, we evaluate eight existing sequence-based and interaction-aware models, assessing binary binding prediction and binding-site localization. Results reveal limited binding-site localization despite strong binary binding prediction, with marked variation across non-covalent interaction types. Overall, InteractBind establishes a benchmark paradigm that encourages the development of more interpretable and physically grounded protein-ligand models.

Yougang Lyu, Xi Zhang, Xinhao Yi et al.

The increasing adoption of Large Language Models (LLMs) has enabled AI scientists to perform complex end-to-end scientific discovery tasks requiring coordination of specialized roles, including idea generation and experimental execution. However, most state-of-the-art AI scientist systems rely on static, hand-designed pipelines and fail to adapt based on accumulated interaction histories. As a result, these systems overlook promising research directions, repeat failed experiments, and pursue infeasible ideas. To address this, we introduce EvoScientist, an evolving multi-agent AI scientist framework that continuously improves research strategies through persistent memory and self-evolution. EvoScientist comprises three specialized agents: a Researcher Agent (RA) for scientific idea generation, an Engineer Agent (EA) for experiment implementation and execution, and an Evolution Manager Agent (EMA) that distills insights from prior interactions into reusable knowledge. EvoScientist contains two persistent memory modules: (i) an ideation memory, which summarizes feasible research directions from top-ranked ideas while recording previously unsuccessful directions; and (ii) an experimentation memory, which captures effective data processing and model training strategies derived from code search trajectories and best-performing implementations. These modules enable the RA and EA to retrieve relevant prior strategies, improving idea quality and code execution success rates over time. Experiments show that EvoScientist outperforms 7 open-source and commercial state-of-the-art systems in scientific idea generation, achieving higher novelty, feasibility, relevance, and clarity via automatic and human evaluation. EvoScientist also substantially improves code execution success rates through multi-agent evolution, demonstrating persistent memory's effectiveness for end-to-end scientific discovery.

Meiru Zhang, Zaiqiao Meng, Nigel Collier

Despite scaling to massive context windows, Large Language Models (LLMs) struggle with multi-hop reasoning due to inherent position bias, which causes them to overlook information at certain positions. Whether these failures stem from an inability to locate evidence (recognition failure) or integrate it (synthesis failure) is unclear. We introduce Multi-Focus Attention Instruction (MFAI), a semantic probe to disentangle these mechanisms by explicitly steering attention towards selected positions. Across 5 LLMs on two multi-hop QA tasks (MuSiQue and NeoQA), we identify the "Weakest Link Effect": in our 18-document, 3-bucket setting, multi-hop reasoning performance collapses to the level of the least visible evidence, governed by absolute position rather than the linear distance between facts. While matched MFAI resolves recognition bottlenecks, improving accuracy by up to 11.49% in low-visibility positions, misleading MFAI yields divergent effects modulated by task topology: entity-centric tasks with vertical reasoning chains are vulnerable, whereas event-centric tasks with horizontal evidence structures are more resilient. Finally, we demonstrate that thinking models utilizing System-2 reasoning effectively locate and integrate the required information, matching gold-only baselines even in noisy, long-context settings. Supplementary experiments on 2WikiMultiHopQA, extended 3-4 hop counts, and a 32B model confirm these findings generalize across datasets, reasoning depths, and model scales.

Jinpeng Wang, Bin Chen, Qiang Zhang et al.

Deep quantization methods have shown high efficiency on large-scale image retrieval. However, current models heavily rely on ground-truth information, hindering the application of quantization in label-hungry scenarios. A more realistic demand is to learn from inexhaustible uploaded images that are associated with informal tags provided by amateur users. Though such sketchy tags do not obviously reveal the labels, they actually contain useful semantic information for supervising deep quantization. To this end, we propose Weakly-Supervised Deep Hyperspherical Quantization (WSDHQ), which is the first work to learn deep quantization from weakly tagged images. Specifically, 1) we use word embeddings to represent the tags and enhance their semantic information based on a tag correlation graph. 2) To better preserve semantic information in quantization codes and reduce quantization error, we jointly learn semantics-preserving embeddings and supervised quantizer on hypersphere by employing a well-designed fusion layer and tailor-made loss functions. Extensive experiments show that WSDHQ can achieve state-of-art performance on weakly-supervised compact coding. Code is available at https://github.com/gimpong/AAAI21-WSDHQ.

Yingxu Wang, Siwei Liu, Jinyuan Fang et al.

Multi-agent systems (MAS) have emerged as a powerful paradigm for orchestrating large language models (LLMs) and specialized tools to collaboratively address complex tasks. However, existing MAS frameworks often require manual workflow configuration and lack native support for dynamic evolution and performance optimization. In addition, many MAS optimization algorithms are not integrated into a unified framework. In this paper, we present EvoAgentX, an open-source platform that automates the generation, execution, and evolutionary optimization of multi-agent workflows. EvoAgentX employs a modular architecture consisting of five core layers: the basic components, agent, workflow, evolving, and evaluation layers. Specifically, within the evolving layer, EvoAgentX integrates three MAS optimization algorithms, TextGrad, AFlow, and MIPRO, to iteratively refine agent prompts, tool configurations, and workflow topologies. We evaluate EvoAgentX on HotPotQA, MBPP, and MATH for multi-hop reasoning, code generation, and mathematical problem solving, respectively, and further assess it on real-world tasks using GAIA. Experimental results show that EvoAgentX consistently achieves significant performance improvements, including a 7.44% increase in HotPotQA F1, a 10.00% improvement in MBPP pass@1, a 10.00% gain in MATH solve accuracy, and an overall accuracy improvement of up to 20.00% on GAIA. The source code is available at: https://github.com/EvoAgentX/EvoAgentX

Justin Xu, Xi Zhang, Javid Abderezaei et al.

We introduce RadEval, a unified, open-source framework for evaluating radiology texts. RadEval consolidates a diverse range of metrics, from classic n-gram overlap (BLEU, ROUGE) and contextual measures (BERTScore) to clinical concept-based scores (F1CheXbert, F1RadGraph, RaTEScore, SRR-BERT, TemporalEntityF1) and advanced LLM-based evaluators (GREEN). We refine and standardize implementations, extend GREEN to support multiple imaging modalities with a more lightweight model, and pretrain a domain-specific radiology encoder, demonstrating strong zero-shot retrieval performance. We also release a richly annotated expert dataset with over 450 clinically significant error labels and show how different metrics correlate with radiologist judgment. Finally, RadEval provides statistical testing tools and baseline model evaluations across multiple publicly available datasets, facilitating reproducibility and robust benchmarking in radiology report generation.

Auss Abbood, Zaiqiao Meng, Nigel Collier

Temporal question answering is an established method for evaluating temporal reasoning in large language models. Expected answers are often numeric (e.g., dates or durations), yet model responses are evaluated like regular text with exact match (EM), unable to distinguish small from large errors. In this investigative work, we frame temporal question answering as a numerical estimation task to assess the shortcomings of EM. We introduce TempAnswerQA, a benchmark distilled from Test of Time and TempTabQA, where all questions require a numerical, temporal answer, allowing us to evaluate models beyond EM. We use the forecasting metrics symmetric mean absolute percentage error (sMAPE) and mean absolute scaled error (MASE). With sMAPE, we find that error size and EM are decoupled. Models with low EM still have low sMAPE (both ~20%), and some models have high sMAPE despite high EM. Scaling errors by the deviation of the ground truth data with MASE reshuffles model rankings compared to EM, revealing gaps in models' understanding of temporal domain knowledge, especially when trained with synthetic data. Lastly, the models' most frequent error is to deviate by only $\pm1$ from the ground truth. sMAPE and MASE, unlike EM, adequately weight these errors. Our findings underscore the need for specialised metrics for temporal QA tasks. Code and data are available on https://github.com/aauss/temporal-answer-qa.

Yu Wang, Xin Xin, Zaiqiao Meng et al.

Learning from implicit feedback is one of the most common cases in the application of recommender systems. Generally speaking, interacted examples are considered as positive while negative examples are sampled from uninteracted ones. However, noisy examples are prevalent in real-world implicit feedback. A noisy positive example could be interacted but it actually leads to negative user preference. A noisy negative example which is uninteracted because of unawareness of the user could also denote potential positive user preference. Conventional training methods overlook these noisy examples, leading to sub-optimal recommendations. In this work, we propose a novel framework to learn robust recommenders from implicit feedback. Through an empirical study, we find that different models make relatively similar predictions on clean examples which denote the real user preference, while the predictions on noisy examples vary much more across different models. Motivated by this observation, we propose denoising with cross-model agreement(DeCA) which aims to minimize the KL-divergence between the real user preference distributions parameterized by two recommendation models while maximizing the likelihood of data observation. We employ the proposed DeCA on four state-of-the-art recommendation models and conduct experiments on four datasets. Experimental results demonstrate that DeCA significantly improves recommendation performance compared with normal training and other denoising methods. Codes will be open-sourced.

Zaiqiao Meng, Hao Zhou, Yifang Chen

Visual Language Models (VLMs) are essential for various tasks, particularly visual reasoning tasks, due to their robust multi-modal information integration, visual reasoning capabilities, and contextual awareness. However, existing \VLMs{}' visual spatial reasoning capabilities are often inadequate, struggling even with basic tasks such as distinguishing left from right. To address this, we propose the \ours{} model, designed to enhance the visual spatial reasoning abilities of VLMS. ZeroVLM employs Zero-1-to-3, a 3D reconstruction model for obtaining different views of the input images and incorporates a prompting mechanism to further improve visual spatial reasoning. Experimental results on four visual spatial reasoning datasets show that our \ours{} achieves up to 19.48% accuracy improvement, which indicates the effectiveness of the 3D reconstruction and prompting mechanisms of our ZeroVLM.

Giacomo Frisoni, Alessio Cocchieri, Alex Presepi et al.

Medical open-domain question answering demands substantial access to specialized knowledge. Recent efforts have sought to decouple knowledge from model parameters, counteracting architectural scaling and allowing for training on common low-resource hardware. The retrieve-then-read paradigm has become ubiquitous, with model predictions grounded on relevant knowledge pieces from external repositories such as PubMed, textbooks, and UMLS. An alternative path, still under-explored but made possible by the advent of domain-specific large language models, entails constructing artificial contexts through prompting. As a result, "to generate or to retrieve" is the modern equivalent of Hamlet's dilemma. This paper presents MedGENIE, the first generate-then-read framework for multiple-choice question answering in medicine. We conduct extensive experiments on MedQA-USMLE, MedMCQA, and MMLU, incorporating a practical perspective by assuming a maximum of 24GB VRAM. MedGENIE sets a new state-of-the-art in the open-book setting of each testbed, allowing a small-scale reader to outcompete zero-shot closed-book 175B baselines while using up to 706$\times$ fewer parameters. Our findings reveal that generated passages are more effective than retrieved ones in attaining higher accuracy.

Jinyuan Fang, Yanwen Peng, Xi Zhang et al. · cambridge

Recent advances in large language models have sparked growing interest in AI agents capable of solving complex, real-world tasks. However, most existing agent systems rely on manually crafted configurations that remain static after deployment, limiting their ability to adapt to dynamic and evolving environments. To this end, recent research has explored agent evolution techniques that aim to automatically enhance agent systems based on interaction data and environmental feedback. This emerging direction lays the foundation for self-evolving AI agents, which bridge the static capabilities of foundation models with the continuous adaptability required by lifelong agentic systems. In this survey, we provide a comprehensive review of existing techniques for self-evolving agentic systems. Specifically, we first introduce a unified conceptual framework that abstracts the feedback loop underlying the design of self-evolving agentic systems. The framework highlights four key components: System Inputs, Agent System, Environment, and Optimisers, serving as a foundation for understanding and comparing different strategies. Based on this framework, we systematically review a wide range of self-evolving techniques that target different components of the agent system. We also investigate domain-specific evolution strategies developed for specialised fields such as biomedicine, programming, and finance, where optimisation objectives are tightly coupled with domain constraints. In addition, we provide a dedicated discussion on the evaluation, safety, and ethical considerations for self-evolving agentic systems, which are critical to ensuring their effectiveness and reliability. This survey aims to provide researchers and practitioners with a systematic understanding of self-evolving AI agents, laying the foundation for the development of more adaptive, autonomous, and lifelong agentic systems.

Ruihong Zeng, Jinyuan Fang, Siwei Liu et al.

Memory plays a pivotal role in enabling large language model~(LLM)-based agents to engage in complex and long-term interactions, such as question answering (QA) and dialogue systems. While various memory modules have been proposed for these tasks, the impact of different memory structures across tasks remains insufficiently explored. This paper investigates how memory structures and memory retrieval methods affect the performance of LLM-based agents. Specifically, we evaluate four types of memory structures, including chunks, knowledge triples, atomic facts, and summaries, along with mixed memory that combines these components. In addition, we evaluate three widely used memory retrieval methods: single-step retrieval, reranking, and iterative retrieval. Extensive experiments conducted across four tasks and six datasets yield the following key insights: (1) Different memory structures offer distinct advantages, enabling them to be tailored to specific tasks; (2) Mixed memory structures demonstrate remarkable resilience in noisy environments; (3) Iterative retrieval consistently outperforms other methods across various scenarios. Our investigation aims to inspire further research into the design of memory systems for LLM-based agents.

Zijun Long, George Killick, Lipeng Zhuang et al.

State-of-the-art pre-trained image models predominantly adopt a two-stage approach: initial unsupervised pre-training on large-scale datasets followed by task-specific fine-tuning using Cross-Entropy loss~(CE). However, it has been demonstrated that CE can compromise model generalization and stability. While recent works employing contrastive learning address some of these limitations by enhancing the quality of embeddings and producing better decision boundaries, they often overlook the importance of hard negative mining and rely on resource intensive and slow training using large sample batches. To counter these issues, we introduce a novel approach named CLCE, which integrates Label-Aware Contrastive Learning with CE. Our approach not only maintains the strengths of both loss functions but also leverages hard negative mining in a synergistic way to enhance performance. Experimental results demonstrate that CLCE significantly outperforms CE in Top-1 accuracy across twelve benchmarks, achieving gains of up to 3.52% in few-shot learning scenarios and 3.41% in transfer learning settings with the BEiT-3 model. Importantly, our proposed CLCE approach effectively mitigates the dependency of contrastive learning on large batch sizes such as 4096 samples per batch, a limitation that has previously constrained the application of contrastive learning in budget-limited hardware environments.

Siwei Liu, Jinyuan Fang, Han Zhou et al. · cambridge

Large Language Models (LLMs) have demonstrated effectiveness in code generation tasks. To enable LLMs to address more complex coding challenges, existing research has focused on crafting multi-agent systems with agentic workflows, where complex coding tasks are decomposed into sub-tasks, assigned to specialized agents. Despite their effectiveness, current approaches heavily rely on hand-crafted agentic workflows, with both agent topologies and prompts manually designed, which limits their ability to automatically adapt to different types of coding problems. To address these limitations and enable automated workflow design, we propose \textbf{S}elf-\textbf{E}volving \textbf{W}orkflow (\textbf{SEW}), a novel self-evolving framework that automatically generates and optimises multi-agent workflows. Extensive experiments on three coding benchmark datasets, including the challenging LiveCodeBench, demonstrate that our SEW can automatically design agentic workflows and optimise them through self-evolution, bringing up to 33\% improvement on LiveCodeBench compared to using the backbone LLM only. Furthermore, by investigating different representation schemes of workflow, we provide insights into the optimal way to encode workflow information with text.

Jinyuan Fang, Zaiqiao Meng, Craig Macdonald

Iterative retrieval-augmented generation (iRAG) models offer an effective approach for multi-hop question answering (QA). However, their retrieval process faces two key challenges: (1) it can be disrupted by irrelevant documents or factually inaccurate chain-of-thoughts; (2) their retrievers are not designed to dynamically adapt to the evolving information needs in multi-step reasoning, making it difficult to identify and retrieve the missing information required at each iterative step. Therefore, we propose KiRAG, which uses a knowledge-driven iterative retriever model to enhance the retrieval process of iRAG. Specifically, KiRAG decomposes documents into knowledge triples and performs iterative retrieval with these triples to enable a factually reliable retrieval process. Moreover, KiRAG integrates reasoning into the retrieval process to dynamically identify and retrieve knowledge that bridges information gaps, effectively adapting to the evolving information needs. Empirical results show that KiRAG significantly outperforms existing iRAG models, with an average improvement of 9.40% in R@3 and 5.14% in F1 on multi-hop QA.

Xi Zhang, Zaiqiao Meng, Jake Lever et al.

Radiology report generation (RRG) requires advanced medical image analysis, effective temporal reasoning, and accurate text generation. While multimodal large language models (MLLMs) align with pre-trained vision encoders to enhance visual-language understanding, most existing methods rely on single-image analysis or rule-based heuristics to process multiple images, failing to fully leverage temporal information in multi-modal medical datasets. In this paper, we introduce Libra, a temporal-aware MLLM tailored for chest X-ray report generation. Libra combines a radiology-specific image encoder with a novel Temporal Alignment Connector (TAC), designed to accurately capture and integrate temporal differences between paired current and prior images. Extensive experiments on the MIMIC-CXR dataset demonstrate that Libra establishes a new state-of-the-art benchmark among similarly scaled MLLMs, setting new standards in both clinical relevance and lexical accuracy.

Xi Zhang, Zaiqiao Meng, Jake Lever et al.

We introduce a radiology-focused visual language model designed to generate radiology reports from chest X-rays. Building on previous findings that large language models (LLMs) can acquire multimodal capabilities when aligned with pretrained vision encoders, we demonstrate similar potential with chest X-ray images. This integration enhances the ability of model to understand and describe chest X-ray images. Our model combines an image encoder with a fine-tuned LLM based on the Vicuna-7B architecture, enabling it to generate different sections of a radiology report with notable accuracy. The training process involves a two-stage approach: (i) initial alignment of chest X-ray features with the LLM (ii) followed by fine-tuning for radiology report generation.

Xinhao Yi, Jake Lever, Kevin Bryson et al.

Knowledge editing has emerged as an effective approach for updating large language models (LLMs) by modifying their internal knowledge. However, their application to the biomedical domain faces unique challenges due to the long-tailed distribution of biomedical knowledge, where rare and infrequent information is prevalent. In this paper, we conduct the first comprehensive study to investigate the effectiveness of knowledge editing methods for editing long-tail biomedical knowledge. Our results indicate that, while existing editing methods can enhance LLMs' performance on long-tail biomedical knowledge, their performance on long-tail knowledge remains inferior to that on high-frequency popular knowledge, even after editing. Our further analysis reveals that long-tail biomedical knowledge contains a significant amount of one-to-many knowledge, where one subject and relation link to multiple objects. This high prevalence of one-to-many knowledge limits the effectiveness of knowledge editing in improving LLMs' understanding of long-tail biomedical knowledge, highlighting the need for tailored strategies to bridge this performance gap.

Zhaohan Meng, Zaiqiao Meng, Siwei Liu et al.

Large Language Models (LLMs) have shown strong performance on static medical Question Answering (QA) tasks, yet their reasoning often deteriorates in multi-turn clinical dialogues where patient information is scattered across turns. This paper introduces TriMediQ, a triplet-structured approach that enhances the reasoning reliability of LLMs through explicit knowledge integration. TriMediQ first employs a frozen triplet extraction LLM to convert patient responses into clinically grounded triplets, ensuring factual precision via constrained prompting. These triplets are incorporated into a patient-specific Knowledge Graph (KG), from which a trainable projection module consisting of a graph encoder and a projector captures relational dependencies while keeping all LLM parameters frozen. During inference, the projection module guides multi-hop reasoning over the KG, enabling coherent clinical dialogue understanding. Experiments on two interactive medical QA benchmarks show that TriMediQ achieves up to 10.4\% improvement in accuracy over five existing baselines on the iMedQA dataset. These results demonstrate that structuring patient information as triplets can effectively improve the reasoning capability of LLMs in multi-turn medical QA.

Xi Zhang, Zaiqiao Meng, Jake Lever et al.

Multimodal large language models (MLLMs) have recently achieved remarkable progress in radiology by integrating visual perception with natural language understanding. However, they often generate clinically unsupported descriptions, known as medical hallucinations, which pose serious risks in medical applications that demand accuracy and image-grounded outputs. Through empirical analysis, we find that prompt-induced hallucinations remain prevalent in radiology MLLMs, largely due to over-sensitivity to clinical sections. To address this, we introduce Clinical Contrastive Decoding (CCD), a training-free and retrieval-free inference framework that integrates structured clinical signals from task-specific radiology expert models. CCD introduces a dual-stage contrastive mechanism to refine token-level logits during generation, thereby enhancing clinical fidelity without modifying the base MLLM. Experiments on three datasets and multiple models demonstrate that CCD consistently improves overall performance on radiology report generation (RRG). On the MIMIC-CXR dataset, it yields up to a 17% improvement in RadGraph-F1 when applied to state-of-the-art RRG models. Our approach provides a lightweight and generalisable solution for mitigating medical hallucinations, effectively bridging expert models and MLLMs in radiology.

Francesco Dalla Serra, Patrick Schrempf, Chaoyang Wang et al.

We present a novel approach to Chest X-ray (CXR) Visual Question Answering (VQA), addressing both single-image image-difference questions. Single-image questions focus on abnormalities within a specific CXR ("What abnormalities are seen in image X?"), while image-difference questions compare two longitudinal CXRs acquired at different time points ("What are the differences between image X and Y?"). We further explore how the integration of radiology reports can enhance the performance of VQA models. While previous approaches have demonstrated the utility of radiology reports during the pre-training phase, we extend this idea by showing that the reports can also be leveraged as additional input to improve the VQA model's predicted answers. First, we propose a unified method that handles both types of questions and auto-regressively generates the answers. For single-image questions, the model is provided with a single CXR. For image-difference questions, the model is provided with two CXRs from the same patient, captured at different time points, enabling the model to detect and describe temporal changes. Taking inspiration from 'Chain-of-Thought reasoning', we demonstrate that performance on the CXR VQA task can be improved by grounding the answer generator module with a radiology report predicted for the same CXR. In our approach, the VQA model is divided into two steps: i) Report Generation (RG) and ii) Answer Generation (AG). Our results demonstrate that incorporating predicted radiology reports as evidence to the AG model enhances performance on both single-image and image-difference questions, achieving state-of-the-art results on the Medical-Diff-VQA dataset.

Meiru Zhang, Zaiqiao Meng, Nigel Collier

The context window of large language models has been extended to 128k tokens or more. However, language models still suffer from position bias and have difficulty in accessing and using the middle part of the context due to the lack of attention. We examine the relative position awareness of LLMs and the feasibility of mitigating disproportional attention through prompting. We augment the original task instruction with $\texttt{attention instructions}$ that direct language models to allocate more attention towards a selected segment of the context. We conduct a comprehensive investigation on multi-document question answering task with both position-based and index-based instructions. We find that language models do not have relative position awareness of the context. Nevertheless, they demonstrate the capacity to adapt attention to a specific segment using matching indexes. Our analysis contributes to a deeper understanding of position bias in LLMs and provides a pathway to mitigate this bias by instruction, thus benefiting LLMs in locating and utilizing relevant information from retrieved documents in RAG applications.

Jinyuan Fang, Zaiqiao Meng, Craig Macdonald

Retrieval-augmented generation (RAG) offers an effective approach for addressing question answering (QA) tasks. However, the imperfections of the retrievers in RAG models often result in the retrieval of irrelevant information, which could introduce noises and degrade the performance, especially when handling multi-hop questions that require multiple steps of reasoning. To enhance the multi-hop reasoning ability of RAG models, we propose TRACE. TRACE constructs knowledge-grounded reasoning chains, which are a series of logically connected knowledge triples, to identify and integrate supporting evidence from the retrieved documents for answering questions. Specifically, TRACE employs a KG Generator to create a knowledge graph (KG) from the retrieved documents, and then uses an Autoregressive Reasoning Chain Constructor to build reasoning chains. Experimental results on three multi-hop QA datasets show that TRACE achieves an average performance improvement of up to 14.03% compared to using all the retrieved documents. Moreover, the results indicate that using reasoning chains as context, rather than the entire documents, is often sufficient to correctly answer questions.

Zhaohan Meng, Zaiqiao Meng, Ke Yuan et al.

Predicting drug-target interaction (DTI) is critical in the drug discovery process. Despite remarkable advances in recent DTI models through the integration of representations from diverse drug and target encoders, such models often struggle to capture the fine-grained interactions between drugs and protein, i.e. the binding of specific drug atoms (or substructures) and key amino acids of proteins, which is crucial for understanding the binding mechanisms and optimising drug design. To address this issue, this paper introduces a novel model, called FusionDTI, which uses a token-level Fusion module to effectively learn fine-grained information for Drug-Target Interaction. In particular, our FusionDTI model uses the SELFIES representation of drugs to mitigate sequence fragment invalidation and incorporates the structure-aware (SA) vocabulary of target proteins to address the limitation of amino acid sequences in structural information, additionally leveraging pre-trained language models extensively trained on large-scale biomedical datasets as encoders to capture the complex information of drugs and targets. Experiments on three well-known benchmark datasets show that our proposed FusionDTI model achieves the best performance in DTI prediction compared with seven existing state-of-the-art baselines. Furthermore, our case study indicates that FusionDTI could highlight the potential binding sites, enhancing the explainability of the DTI prediction.

Zihao Fu, Meiru Zhang, Zaiqiao Meng et al.

Infectious disease outbreaks continue to pose a significant threat to human health and well-being. To improve disease surveillance and understanding of disease spread, several surveillance systems have been developed to monitor daily news alerts and social media. However, existing systems lack thorough epidemiological analysis in relation to corresponding alerts or news, largely due to the scarcity of well-annotated reports data. To address this gap, we introduce the Biomedical Alert News Dataset (BAND), which includes 1,508 samples from existing reported news articles, open emails, and alerts, as well as 30 epidemiology-related questions. These questions necessitate the model's expert reasoning abilities, thereby offering valuable insights into the outbreak of the disease. The BAND dataset brings new challenges to the NLP world, requiring better disguise capability of the content and the ability to infer important information. We provide several benchmark tasks, including Named Entity Recognition (NER), Question Answering (QA), and Event Extraction (EE), to show how existing models are capable of handling these tasks in the epidemiology domain. To the best of our knowledge, the BAND corpus is the largest corpus of well-annotated biomedical outbreak alert news with elaborately designed questions, making it a valuable resource for epidemiologists and NLP researchers alike.

Zihao Fu, Yixuan Su, Zaiqiao Meng et al.

Biomedical named entity recognition is one of the core tasks in biomedical natural language processing (BioNLP). To tackle this task, numerous supervised/distantly supervised approaches have been proposed. Despite their remarkable success, these approaches inescapably demand laborious human effort. To alleviate the need of human effort, dictionary-based approaches have been proposed to extract named entities simply based on a given dictionary. However, one downside of existing dictionary-based approaches is that they are challenged to identify concept synonyms that are not listed in the given dictionary, which we refer as the synonym generalization problem. In this study, we propose a novel Synonym Generalization (SynGen) framework that recognizes the biomedical concepts contained in the input text using span-based predictions. In particular, SynGen introduces two regularization terms, namely, (1) a synonym distance regularizer; and (2) a noise perturbation regularizer, to minimize the synonym generalization error. To demonstrate the effectiveness of our approach, we provide a theoretical analysis of the bound of synonym generalization error. We extensively evaluate our approach on a wide range of benchmarks and the results verify that SynGen outperforms previous dictionary-based models by notable margins. Lastly, we provide a detailed analysis to further reveal the merits and inner-workings of our approach.

Guanzheng Chen, Fangyu Liu, Zaiqiao Meng et al.

Parameter-Efficient Tuning (PETuning) methods have been deemed by many as the new paradigm for using pretrained language models (PLMs). By tuning just a fraction amount of parameters comparing to full model finetuning, PETuning methods claim to have achieved performance on par with or even better than finetuning. In this work, we take a step back and re-examine these PETuning methods by conducting the first comprehensive investigation into the training and evaluation of them. We found the problematic validation and testing practice in current studies, when accompanied by the instability nature of PETuning methods, has led to unreliable conclusions. When being compared under a truly fair evaluation protocol, PETuning cannot yield consistently competitive performance while finetuning remains to be the best-performing method in medium- and high-resource settings. We delve deeper into the cause of the instability and observed that the number of trainable parameters and training iterations are two main factors: reducing trainable parameters and prolonging training iterations may lead to higher stability in PETuning methods.

Yixuan Su, Fangyu Liu, Zaiqiao Meng et al.

Masked language models (MLMs) such as BERT and RoBERTa have revolutionized the field of Natural Language Understanding in the past few years. However, existing pre-trained MLMs often output an anisotropic distribution of token representations that occupies a narrow subset of the entire representation space. Such token representations are not ideal, especially for tasks that demand discriminative semantic meanings of distinct tokens. In this work, we propose TaCL (Token-aware Contrastive Learning), a novel continual pre-training approach that encourages BERT to learn an isotropic and discriminative distribution of token representations. TaCL is fully unsupervised and requires no additional data. We extensively test our approach on a wide range of English and Chinese benchmarks. The results show that TaCL brings consistent and notable improvements over the original BERT model. Furthermore, we conduct detailed analysis to reveal the merits and inner-workings of our approach.

Zaiqiao Meng, Fangyu Liu, Ehsan Shareghi et al.

Knowledge probing is crucial for understanding the knowledge transfer mechanism behind the pre-trained language models (PLMs). Despite the growing progress of probing knowledge for PLMs in the general domain, specialised areas such as biomedical domain are vastly under-explored. To catalyse the research in this direction, we release a well-curated biomedical knowledge probing benchmark, MedLAMA, which is constructed based on the Unified Medical Language System (UMLS) Metathesaurus. We test a wide spectrum of state-of-the-art PLMs and probing approaches on our benchmark, reaching at most 3% of acc@10. While highlighting various sources of domain-specific challenges that amount to this underwhelming performance, we illustrate that the underlying PLMs have a higher potential for probing tasks. To achieve this, we propose Contrastive-Probe, a novel self-supervised contrastive probing approach, that adjusts the underlying PLMs without using any probing data. While Contrastive-Probe pushes the acc@10 to 28%, the performance gap still remains notable. Our human expert evaluation suggests that the probing performance of our Contrastive-Probe is still under-estimated as UMLS still does not include the full spectrum of factual knowledge. We hope MedLAMA and Contrastive-Probe facilitate further developments of more suited probing techniques for this domain.

Zaiqiao Meng, Fangyu Liu, Thomas Hikaru Clark et al.

Infusing factual knowledge into pre-trained models is fundamental for many knowledge-intensive tasks. In this paper, we proposed Mixture-of-Partitions (MoP), an infusion approach that can handle a very large knowledge graph (KG) by partitioning it into smaller sub-graphs and infusing their specific knowledge into various BERT models using lightweight adapters. To leverage the overall factual knowledge for a target task, these sub-graph adapters are further fine-tuned along with the underlying BERT through a mixture layer. We evaluate our MoP with three biomedical BERTs (SciBERT, BioBERT, PubmedBERT) on six downstream tasks (inc. NLI, QA, Classification), and the results show that our MoP consistently enhances the underlying BERTs in task performance, and achieves new SOTA performances on five evaluated datasets.

Yixuan Su, Zaiqiao Meng, Simon Baker et al.

Neural table-to-text generation models have achieved remarkable progress on an array of tasks. However, due to the data-hungry nature of neural models, their performances strongly rely on large-scale training examples, limiting their applicability in real-world applications. To address this, we propose a new framework: Prototype-to-Generate (P2G), for table-to-text generation under the few-shot scenario. The proposed framework utilizes the retrieved prototypes, which are jointly selected by an IR system and a novel prototype selector to help the model bridging the structural gap between tables and texts. Experimental results on three benchmark datasets with three state-of-the-art models demonstrate that the proposed framework significantly improves the model performance across various evaluation metrics.

Zaiqiao Meng, Siwei Liu, Craig Macdonald et al.

Leveraging the side information associated with entities (i.e. users and items) to enhance the performance of recommendation systems has been widely recognized as an important modelling dimension. While many existing approaches focus on the integration scheme to incorporate entity side information -- by combining the recommendation loss function with an extra side information-aware loss -- in this paper, we propose instead a novel pre-training scheme for leveraging the side information. In particular, we first pre-train a representation model using the side information of the entities, and then fine-tune it using an existing general representation-based recommendation model. Specifically, we propose two pre-training models, named GCN-P and COM-P, by considering the entities and their relations constructed from side information as two different types of graphs respectively, to pre-train entity embeddings. For the GCN-P model, two single-relational graphs are constructed from all the users' and items' side information respectively, to pre-train entity representations by using the Graph Convolutional Networks. For the COM-P model, two multi-relational graphs are constructed to pre-train the entity representations by using the Composition-based Graph Convolutional Networks. An extensive evaluation of our pre-training models fine-tuned under four general representation-based recommender models, i.e. MF, NCF, NGCF and LightGCN, shows that effectively pre-training embeddings with both the user's and item's side information can significantly improve these original models in terms of both effectiveness and stability.

Fangyu Liu, Ehsan Shareghi, Zaiqiao Meng et al.

Despite the widespread success of self-supervised learning via masked language models (MLM), accurately capturing fine-grained semantic relationships in the biomedical domain remains a challenge. This is of paramount importance for entity-level tasks such as entity linking where the ability to model entity relations (especially synonymy) is pivotal. To address this challenge, we propose SapBERT, a pretraining scheme that self-aligns the representation space of biomedical entities. We design a scalable metric learning framework that can leverage UMLS, a massive collection of biomedical ontologies with 4M+ concepts. In contrast with previous pipeline-based hybrid systems, SapBERT offers an elegant one-model-for-all solution to the problem of medical entity linking (MEL), achieving a new state-of-the-art (SOTA) on six MEL benchmarking datasets. In the scientific domain, we achieve SOTA even without task-specific supervision. With substantial improvement over various domain-specific pretrained MLMs such as BioBERT, SciBERTand and PubMedBERT, our pretraining scheme proves to be both effective and robust.

Zaiqiao Meng, Richard McCreadie, Craig Macdonald et al.

Effective methodologies for evaluating recommender systems are critical, so that such systems can be compared in a sound manner. A commonly overlooked aspect of recommender system evaluation is the selection of the data splitting strategy. In this paper, we both show that there is no standard splitting strategy and that the selection of splitting strategy can have a strong impact on the ranking of recommender systems. In particular, we perform experiments comparing three common splitting strategies, examining their impact over seven state-of-the-art recommendation models for two datasets. Our results demonstrate that the splitting strategy employed is an important confounding variable that can markedly alter the ranking of state-of-the-art systems, making much of the currently published literature non-comparable, even when the same dataset and metrics are used.

Zaiqiao Meng, Shangsong Liang, Jinyuan Fang et al.

Deep generative models (DGMs) have achieved remarkable advances. Semi-supervised variational auto-encoders (SVAE) as a classical DGM offer a principled framework to effectively generalize from small labelled data to large unlabelled ones, but it is difficult to incorporate rich unstructured relationships within the multiple heterogeneous entities. In this paper, to deal with the problem, we present a semi-supervised co-embedding model for attributed networks (SCAN) based on the generalized SVAE for heterogeneous data, which collaboratively learns low-dimensional vector representations of both nodes and attributes for partially labelled attributed networks semi-supervisedly. The node and attribute embeddings obtained in a unified manner by our SCAN can benefit for capturing not only the proximities between nodes but also the affinities between nodes and attributes. Moreover, our model also trains a discriminative network to learn the label predictive distribution of nodes. Experimental results on real-world networks demonstrate that our model yields excellent performance in a number of applications such as attribute inference, user profiling and node classification compared to the state-of-the-art baselines.

Zaiqiao Meng, Richard McCreadie, Craig Macdonald et al.

Grocery recommendation is an important recommendation use-case, which aims to predict which items a user might choose to buy in the future, based on their shopping history. However, existing methods only represent each user and item by single deterministic points in a low-dimensional continuous space. In addition, most of these methods are trained by maximizing the co-occurrence likelihood with a simple Skip-gram-based formulation, which limits the expressive ability of their embeddings and the resulting recommendation performance. In this paper, we propose the Variational Bayesian Context-Aware Representation (VBCAR) model for grocery recommendation, which is a novel variational Bayesian model that learns the user and item latent vectors by leveraging basket context information from past user-item interactions. We train our VBCAR model based on the Bayesian Skip-gram framework coupled with the amortized variational inference so that it can learn more expressive latent representations that integrate both the non-linearity and Bayesian behaviour. Experiments conducted on a large real-world grocery recommendation dataset show that our proposed VBCAR model can significantly outperform existing state-of-the-art grocery recommendation methods.

Teng Xiao, Shangsong Liang, Hong Shen et al.

Collaborative Filtering (CF) is one of the most used methods for Recommender System. Because of the Bayesian nature and nonlinearity, deep generative models, e.g. Variational Autoencoder (VAE), have been applied into CF task, and have achieved great performance. However, most VAE-based methods suffer from matrix sparsity and consider the prior of users' latent factors to be the same, which leads to poor latent representations of users and items. Additionally, most existing methods model latent factors of users only and but not items, which makes them not be able to recommend items to a new user. To tackle these problems, we propose a Neural Variational Hybrid Collaborative Filtering, NVHCF. Specifically, we consider both the generative processes of users and items, and the prior of latent factors of users and items to be side informationspecific, which enables our model to alleviate matrix sparsity and learn better latent representations of users and items. For inference purpose, we derived a Stochastic Gradient Variational Bayes (SGVB) algorithm to analytically approximate the intractable distributions of latent factors of users and items. Experiments conducted on two large datasets have showed our methods significantly outperform the state-of-the-art CF methods, including the VAE-based methods.

Zaiqiao Meng, Hong Shen

Given a large network and a query node, finding its top-k similar nodes is a primitive operation in many graph-based applications. Recently enhancing search results with diversification have received much attention. In this paper, we explore an novel problem of searching for top-k diversified similar nodes in attributed networks, with the motivation that modeling diversification in an attributed network should consider both the emergence of network links and the attribute features of nodes such as user profile information. We formulate this practical problem as two optimization problems: the Attributed Coverage Diversification (ACD) problem and the r-Dissimilar Attributed Coverage Diversification (r-DACD) problem. Based on the submodularity and the monotonicity of ACD, we propose an efficient greedy algorithm achieving a tight approximation guarantee of 1-1/e. Unlike the expension based methods only considering nodes' neighborhood, ACD generalize the definition of diversification to nodes' own features. To capture diversification in topological structure of networks, the r-DACD problem introduce a dissimilarity constraint. We refer to this problem as the Dissimilarity Constrained Non-monotone Submodular Maximization (DCNSM) problem. We prove that there is no constant-factor approximation for DCNSM, and also present an efficient greedy algorithms achieving $1/ρ$ approximation, where $ρ\leΔ$, $Δ$ is the maximum degree of its dissimilarity based graph. To the best of our knowledge, it is the first approximation algorithm for the Submodular Maximization problem with a distance constraint. The experimental results on real-world attributed network datasets demonstrate the effectiveness of our methods, and confirm that adding dissimilarity constraint can significantly enhance the performance of diversification.