Cuiying Honors College, Lanzhou University, Lanzhou, Gansu, China, School of Mathematics and Statistics, Lanzhou University, Lanzhou, Gansu, China
Abstract:As predictive models are increasingly deployed in high-stakes settings such as credit approval, there is a growing need for post-hoc methods that provide recourse to affected individuals. Many such models operate on tabular data, where features correspond to real-world attributes. Recently, in-context learning (ICL) has enabled large language models to perform tabular prediction by conditioning on labeled examples at inference time, without explicit training. However, algorithmic recourse for tabular decision-making under ICL remains largely unexplored. In this work, we present the first study of algorithmic recourse for tabular data under ICL. We carry out a theoretical analysis, showing that recourse remains well-defined and bounded, and we characterize how recourse converges toward classical solutions as the context size increases. In practice, we propose a novel zeroth-order recourse framework, Adaptive Subspace Recourse for In-Context Learning (ASR-ICL), that efficiently generates actionable and sparse recourse for black-box ICL models. The proposed framework naturally extends to multi-class tabular tasks. Experiments across multiple real-world datasets and models demonstrate that ASR-ICL achieves recourse quality comparable to existing methods with fewer queries and empirically confirm the predicted convergence behavior, supporting our theoretical analysis.
Abstract:Safety alignment for large language models (LLMs) aims to reduce harmful or unsafe behavior while preserving general utility. However, recent findings reveal that alignment effects can be fragile: lightweight post-alignment manipulations, such as parameter noise, activation noise, or quantization, can easily weaken the intended safety behavior. Prior efforts to improve robustness have primarily focused on data curation, modified alignment objectives, and safety-critical parameter identification, leaving the role of the optimizer itself largely unexplored. In this paper, we are the first to study the robustness of safety alignment from the perspective of the base optimizer. This optimizer-centric view naturally points to zeroth-order optimization, which provides a robustness-oriented signal by evaluating safety alignment under perturbations. Based on this insight, we propose a hybrid framework that first performs standard first-order safety alignment and then applies zeroth-order refinement to improve robustness. Both theoretically and empirically, we show that only a few zeroth-order refinement steps can enhance robustness while preserving safety alignment. We further improve the efficiency of zeroth-order refinement by exploiting its inherent perturbation-based evaluations to estimate layer-wise robustness sensitivity, enabling the refinement process to concentrate updates on robustness-critical layers with modest training overhead.
Abstract:Point cloud quality plays a critical role in 3D acquisition, reconstruction, rendering, and perception, yet existing point cloud quality assessment (PCQA) research remains largely centered on scalar score prediction. In practical inspection scenarios, quality assessment often involves identifying defects, characterizing dominant issue types, assessing downstream usability, and providing evidence-supported descriptions, which are not explicitly evaluated by current benchmarks. We introduce PointQ-Bench, a benchmark designed to extend PCQA from scalar scoring toward comprehensive quality understanding. PointQ-Bench consists of 3,083 point clouds spanning authentic scans, simulated distortions, and AI-generated content, covering eight major issue types. Each sample is annotated with mean opinion scores (MOS), quality levels, issue tags, expert-grounded descriptions, and 12,332 question-answer pairs. The benchmark supports three perception-oriented tasks: anomaly sensing, defect diagnosis, and usability grading, as well as a cognition-oriented task of open-ended quality reporting. To evaluate free-form quality descriptions, we further propose SSFRQ-5D, a five-dimensional evaluation protocol validated through human-AI agreement analysis. Extensive experiments on 14 vision-language models and traditional PCQA baselines reveal a consistent perception-diagnosis gap: while current models exhibit emerging abilities in coarse defect perception, they struggle with grounded diagnosis and quality calibration. Strong 2D MLLMs generally outperform existing 3D VLMs, and the benefit of additional views or point-level inputs is non-uniform, varying across tasks, data sources, and models, particularly under boundary-ambiguous conditions. Overall, PointQ-Bench provides a diagnostic testbed for advancing reliable and interpretable point cloud quality understanding.
Abstract:Remote sensing question answering (RS-QA) often requires more than direct semantic prediction, especially in large-scale forest scenes where ecological analysis involves multi-step filtering, numerical aggregation, neighborhood reasoning, and verifiable evidence. We introduce ForestHG-Trace, a framework for traceable long-horizon ecological reasoning over forest environments. It represents multimodal NEON forest scenes as ecological hypergraphs, where tree instances, spatial units, semantic groups, and neighborhood relations support higher-order reasoning beyond pairwise scene graphs. An LLM-guided agent then invokes deterministic tools for reading, filtering, expansion, aggregation, comparison, and auditing, producing replayable execution traces and compact evidence records rather than only free-form answers. We further construct ForestTraceQA, an executable benchmark for evaluating ecological QA across diverse task types and reasoning depths. Experiments show that ForestHG-Trace substantially improves answer accuracy and execution faithfulness over single-step baselines and scene-graph agents, while highlighting execution depth as the main bottleneck for long-horizon ecological QA.
Abstract:Multimodal Large Language Models (MLLMs) have recently shown promising progress in geospatial reasoning. However, existing remote sensing benchmarks remain largely 2D-centric, evaluating models primarily on optical appearance. In natural environments, this paradigm breaks down due to severe spectral confusion, where ecologically distinct regions share similar textures but differ fundamentally in vertical structure. In such cases, explicit 3D structural data, such as Canopy Height Models (CHMs), become essential geometric evidence for semantic disambiguation. Yet, it remains unclear whether current MLLMs can genuinely leverage vertical cues to resolve appearance-level ambiguity. To address this gap, we introduce VertiCue-Bench, the first diagnostic benchmark for CHM-grounded geospatial reasoning. VertiCue-Bench comprises 1,534 carefully curated instances across 17 tasks, explicitly disentangling low-level height perception from ambiguity-aware semantic reasoning. Evaluations on 14 state-of-the-art general and remote-sensing-specialized MLLMs, combined with counterfactual modality testing, reveal a striking perception-reasoning dissociation. While models exhibit emerging competence in reading raw CHM height cues, they largely fail to translate geometric perception into reliable semantic reasoning, often underperforming RGB-only baselines when joint constraints are required. Overall, VertiCue-Bench exposes a critical geometry-to-semantics gap in natural scene understanding, offering actionable insights for advancing geospatial MLLMs.
Abstract:Automated medical report generation, MRG, holds substantial value for alleviating radiologist workload and enhancing diagnostic efficiency. However, mainstream approaches typically treat diverse chest abnormalities as isolated classification targets. This paradigm often overlooks inherent disease co-occurrences and struggles to translate medical topological structures into explicit data correlations, constraining the model's reasoning capacity on complex or subtle lesions. To address this, we propose a Graph-Augmented Dual-Stream Medical Report Generation with Topological Internalization, GDMRG. Our framework introduces a Topological Knowledge Internalization module, TKI, which leverages a Graph Convolutional Network, GCN, to generate an explicit parameterized weight matrix based on global disease co-occurrence priors. This facilitates efficient topological knowledge injection without relying on external retrieval mechanisms. Building upon this, we construct a dual-stream classification system: the main branch generates discrete diagnostic prompts under topological constraints, while the auxiliary branch employs an asymmetric optimization strategy to dynamically calibrate decision boundaries for highly imbalanced samples. Concurrently, to establish a logical closed loop between diagnosis and visual grounding, we design a diagnostic-driven Diagnosis-Guided Spatial Attention, DGSA, that utilizes high-dimensional clinical semantics to recalibrate the visual encoder, mitigating feature hallucinations. Comprehensive experiments on the MIMIC-CXR dataset demonstrate that GDMRG achieves competitive clinical efficacy, CE, while maintaining natural language fluency. Furthermore, our model exhibits robust zero-shot generalization on the IU X-Ray dataset. In summary, this work presents an integrated and interpretable paradigm for medical report generation.
Abstract:Cancer survival prediction from multi-omics data remains challenging because prognostic signals are high-dimensional, heterogeneous, and distributed across interacting genes and pathways. We propose PathMoG, a pathway-centric modular graph neural network for multi-omics survival prediction. PathMoG reorganizes genome-scale inputs into 354 KEGG-informed pathway modules, introduces a Hierarchical Omics Modulation module to condition gene-expression representations on mutation, copy number variation, pathway, and clinical context, and uses dual-level attention to capture both intra-pathway driver signals and inter-pathway clinical relevance. We evaluated PathMoG on 5,650 patients across 10 TCGA cancer types and observed consistent improvements over representative survival baselines. The framework further provides gene-level, pathway-level, and patient-level interpretability, supporting biologically grounded and clinically relevant risk stratification.
Abstract:Accurate prediction of drug-target binding affinity accelerates drug discovery by prioritizing compounds for experimental validation. Current methods face three limitations: sequence-based approaches discard spatial geometric constraints, structure-based methods fail to exploit hydrogen bond features, and conventional loss functions neglect prediction-target correlation, a key factor for identifying high-affinity compounds in virtual screening. We developed HBGSA (Hydrogen Bond Graph with Self-Attention), a 3.06M-parameter model that encodes hydrogen bond spatial features. HBGSA uses graph neural networks to model hydrogen bond spatial topology with self-attention enhancement and Pearson correlation loss. Experimental results on PDBbind Core Set and CSAR-HiQ dataset demonstrate that HBGSA outperforms baseline methods with strong generalization capability. Ablation studies confirm the effectiveness of hydrogen bond modeling and Pearson correlation loss.
Abstract:Despite the remarkable success of Vision Transformers (ViTs) across a wide range of vision tasks, recent studies have revealed that they remain vulnerable to adversarial examples, much like Convolutional Neural Networks (CNNs). A common empirical defense strategy is adversarial training, yet the theoretical underpinnings of its robustness in ViTs remain largely unexplored. In this work, we present the first theoretical analysis of adversarial training under simplified ViT architectures. We show that, when trained under a signal-to-noise ratio that satisfies a certain condition and within a moderate perturbation budget, adversarial training enables ViTs to achieve nearly zero robust training loss and robust generalization error under certain regimes. Remarkably, this leads to strong generalization even in the presence of overfitting, a phenomenon known as \emph{benign overfitting}, previously only observed in CNNs (with adversarial training). Experiments on both synthetic and real-world datasets further validate our theoretical findings.
Abstract:Adversarial training (AT) is an effective defense for large language models (LLMs) against jailbreak attacks, but performing AT on LLMs is costly. To improve the efficiency of AT for LLMs, recent studies propose continuous AT (CAT) that searches for adversarial inputs within the continuous embedding space of LLMs during AT. While CAT has achieved empirical success, its underlying mechanism, i.e., why adversarial perturbations in the embedding space can help LLMs defend against jailbreak prompts synthesized in the input token space, remains unknown. This paper presents the first theoretical analysis of CAT on LLMs based on in-context learning (ICL) theory. For linear transformers trained with adversarial examples from the embedding space on in-context linear regression tasks, we prove a robust generalization bound that has a negative correlation with the perturbation radius in the embedding space. This clearly explains why CAT can defend against jailbreak prompts from the LLM's token space. Further, the robust bound shows that the robustness of an adversarially trained LLM is closely related to the singular values of its embedding matrix. Based on this, we propose to improve LLM CAT by introducing an additional regularization term, which depends on singular values of the LLM's embedding matrix, into the objective function of CAT. Experiments on real-world LLMs demonstrate that our method can help LLMs achieve a better jailbreak robustness-utility tradeoff. The code is available at https://github.com/fshp971/continuous-adv-icl.