arXiv subjects

Bo Han

Publications and source records attributed to Bo Han.

At least 145 records · Page 8Linked to original sources

arXiv2025

Exploring Criteria of Loss Reweighting to Enhance LLM Unlearning

Loss reweighting has shown significant benefits for machine unlearning with large language models (LLMs). However, their exact functionalities are left unclear and the optimal strategy remains an open question, thus impeding the understanding and improvement of existing methodologies. In this paper, we identify two distinct goals of loss reweighting, namely, Saturation and Importance -- the former indicates that those insufficiently optimized data should be emphasized, while the latter stresses some critical data that are most influential for loss minimization. To study their usefulness, we design specific reweighting strategies for each goal and evaluate their respective effects on unlearning. We conduct extensive empirical analyses on well-established benchmarks, and summarize some important observations as follows: (i) Saturation enhances efficacy more than importance-based reweighting, and their combination can yield additional improvements. (ii) Saturation typically allocates lower weights to data with lower likelihoods, whereas importance-based reweighting does the opposite. (iii) The efficacy of unlearning is also largely influenced by the smoothness and granularity of the weight distributions. Based on these findings, we propose SatImp, a simple reweighting method that combines the advantages of both saturation and importance. Empirical results on extensive datasets validate the efficacy of our method, potentially bridging existing research gaps and indicating directions for future research. Our code is available at https://github.com/tmlr-group/SatImp.

cs.LG↗

arXiv2025

Corrupted but Not Broken: Understanding and Mitigating the Negative Impacts of Corrupted Data in Visual Instruction Tuning

Visual Instruction Tuning (VIT) aims to enhance Multimodal Large Language Models (MLLMs), yet its effectiveness is often compromised by corrupted datasets with issues such as hallucinated content, incorrect responses, and poor OCR quality. Previous approaches to address these challenges have focused on refining datasets through high-quality data collection or rule-based filtering that can be costly or limited in scope. In this paper, we conduct a systematic investigation into the impact of corrupted data on MLLMs and discover that, although corrupted data degrade model performance, such adverse effects are largely reversible, and MLLMs are {\bf corrupted but not broken}. Specifically, we find that disabling a small subset of parameters can almost fully restore performance. Moreover, corrupted MLLMs inherently possess the capability to differentiate between clean and corrupted samples, facilitating dataset cleaning without external intervention. Building on these insights, we introduce a corruption-robust training paradigm that significantly surpasses existing strategies for mitigating the effects of corrupted data.

cs.CV↗

arXiv2025

VersatileMotion: A Unified Framework for Motion Synthesis and Comprehension

Large language models (LLMs) are, by design, inherently capable of multi-task learning: through a unified next-token prediction paradigm, they can naturally address a wide variety of downstream tasks. Prior work in the motion domain has demonstrated some generality by adapting LLMs via a Motion Tokenizer coupled with an autoregressive Transformer to generate and understand human motion. However, this generality remains limited in scope and yields only modest performance gains. We introduce VersatileMotion, a unified multimodal motion LLM that combines a novel motion tokenizer, integrating VQ-VAE with flow matching, and an autoregressive transformer backbone to seamlessly support at least nine distinct motion-related tasks. VersatileMotion is the first method to handle single-agent and multi-agent motions in a single framework and enable cross-modal conversion between motion, text, music, and speech, achieving state-of-the-art performance on seven of these tasks. Each sequence in MotionHub may include one or more of the following annotations: natural-language captions, music or audio clips, speech transcripts, and multi-agent interaction data. To facilitate evaluation, we define and release benchmark splits covering nine core tasks. Extensive experiments demonstrate the superior performance, versatility, and potential of VersatileMotion as a foundational model for future understanding and generation of motion.

cs.CV↗

arXiv2025

Learning without Isolation: Pathway Protection for Continual Learning

Deep networks are prone to catastrophic forgetting during sequential task learning, i.e., losing the knowledge about old tasks upon learning new tasks. To this end, continual learning(CL) has emerged, whose existing methods focus mostly on regulating or protecting the parameters associated with the previous tasks. However, parameter protection is often impractical, since the size of parameters for storing the old-task knowledge increases linearly with the number of tasks, otherwise it is hard to preserve the parameters related to the old-task knowledge. In this work, we bring a dual opinion from neuroscience and physics to CL: in the whole networks, the pathways matter more than the parameters when concerning the knowledge acquired from the old tasks. Following this opinion, we propose a novel CL framework, learning without isolation(LwI), where model fusion is formulated as graph matching and the pathways occupied by the old tasks are protected without being isolated. Thanks to the sparsity of activation channels in a deep network, LwI can adaptively allocate available pathways for a new task, realizing pathway protection and addressing catastrophic forgetting in a parameter-efficient manner. Experiments on popular benchmark datasets demonstrate the superiority of the proposed LwI.

cs.LG↗

arXiv2025

On the Thinking-Language Modeling Gap in Large Language Models

System 2 reasoning is one of the defining characteristics of intelligence, which requires slow and logical thinking. Human conducts System 2 reasoning via the language of thoughts that organizes the reasoning process as a causal sequence of mental language, or thoughts. Recently, it has been observed that System 2 reasoning can be elicited from Large Language Models (LLMs) pre-trained on large-scale natural languages. However, in this work, we show that there is a significant gap between the modeling of languages and thoughts. As language is primarily a tool for humans to share knowledge and thinking, modeling human language can easily absorb language biases into LLMs deviated from the chain of thoughts in minds. Furthermore, we show that the biases will mislead the eliciting of "thoughts" in LLMs to focus only on a biased part of the premise. To this end, we propose a new prompt technique termed Language-of-Thoughts (LoT) to demonstrate and alleviate this gap. Instead of directly eliciting the chain of thoughts from partial information, LoT instructs LLMs to adjust the order and token used for the expressions of all the relevant information. We show that the simple strategy significantly reduces the language modeling biases in LLMs and improves the performance of LLMs across a variety of reasoning tasks.

cs.CL↗

arXiv2025

Irregular Tensor Low-Rank Representation for Hyperspectral Image Representation

Spectral variations pose a common challenge in analyzing hyperspectral images (HSI). To address this, low-rank tensor representation has emerged as a robust strategy, leveraging inherent correlations within HSI data. However, the spatial distribution of ground objects in HSIs is inherently irregular, existing naturally in tensor format, with numerous class-specific regions manifesting as irregular tensors. Current low-rank representation techniques are designed for regular tensor structures and overlook this fundamental irregularity in real-world HSIs, leading to performance limitations. To tackle this issue, we propose a novel model for irregular tensor low-rank representation tailored to efficiently model irregular 3D cubes. By incorporating a non-convex nuclear norm to promote low-rankness and integrating a global negative low-rank term to enhance the discriminative ability, our proposed model is formulated as a constrained optimization problem and solved using an alternating augmented Lagrangian method. Experimental validation conducted on four public datasets demonstrates the superior performance of our method compared to existing state-of-the-art approaches. The code is publicly available at https://github.com/hb-studying/ITLRR.

cs.CV↗

arXiv2025

Understanding and Enhancing the Transferability of Jailbreaking Attacks

Jailbreaking attacks can effectively manipulate open-source large language models (LLMs) to produce harmful responses. However, these attacks exhibit limited transferability, failing to disrupt proprietary LLMs consistently. To reliably identify vulnerabilities in proprietary LLMs, this work investigates the transferability of jailbreaking attacks by analysing their impact on the model's intent perception. By incorporating adversarial sequences, these attacks can redirect the source LLM's focus away from malicious-intent tokens in the original input, thereby obstructing the model's intent recognition and eliciting harmful responses. Nevertheless, these adversarial sequences fail to mislead the target LLM's intent perception, allowing the target LLM to refocus on malicious-intent tokens and abstain from responding. Our analysis further reveals the inherent distributional dependency within the generated adversarial sequences, whose effectiveness stems from overfitting the source LLM's parameters, resulting in limited transferability to target LLMs. To this end, we propose the Perceived-importance Flatten (PiF) method, which uniformly disperses the model's focus across neutral-intent tokens in the original input, thus obscuring malicious-intent tokens without relying on overfitted adversarial sequences. Extensive experiments demonstrate that PiF provides an effective and efficient red-teaming evaluation for proprietary LLMs.

cs.LG↗

arXiv2025

Noisy Test-Time Adaptation in Vision-Language Models

Test-time adaptation (TTA) aims to address distribution shifts between source and target data by relying solely on target data during testing. In open-world scenarios, models often encounter noisy samples, i.e., samples outside the in-distribution (ID) label space. Leveraging the zero-shot capability of pre-trained vision-language models (VLMs), this paper introduces Zero-Shot Noisy TTA (ZS-NTTA), focusing on adapting the model to target data with noisy samples during test-time in a zero-shot manner. We find existing TTA methods underperform under ZS-NTTA, often lagging behind even the frozen model. We conduct comprehensive experiments to analyze this phenomenon, revealing that the negative impact of unfiltered noisy data outweighs the benefits of clean data during model updating. Also, adapting a classifier for ID classification and noise detection hampers both sub-tasks. Built on this, we propose a framework that decouples the classifier and detector, focusing on developing an individual detector while keeping the classifier frozen. Technically, we introduce the Adaptive Noise Detector (AdaND), which utilizes the frozen model's outputs as pseudo-labels to train a noise detector. To handle clean data streams, we further inject Gaussian noise during adaptation, preventing the detector from misclassifying clean samples as noisy. Beyond the ZS-NTTA, AdaND can also improve the zero-shot out-of-distribution (ZS-OOD) detection ability of VLMs. Experiments show that AdaND outperforms in both ZS-NTTA and ZS-OOD detection. On ImageNet, AdaND achieves a notable improvement of $8.32\%$ in harmonic mean accuracy ($\text{Acc}_\text{H}$) for ZS-NTTA and $9.40\%$ in FPR95 for ZS-OOD detection, compared to SOTA methods. Importantly, AdaND is computationally efficient and comparable to the model-frozen method. The code is publicly available at: https://github.com/tmlr-group/ZS-NTTA.

cs.LG↗

arXiv2025

Classifying Long-tailed and Label-noise Data via Disentangling and Unlearning

In real-world datasets, the challenges of long-tailed distributions and noisy labels often coexist, posing obstacles to the model training and performance. Existing studies on long-tailed noisy label learning (LTNLL) typically assume that the generation of noisy labels is independent of the long-tailed distribution, which may not be true from a practical perspective. In real-world situaiton, we observe that the tail class samples are more likely to be mislabeled as head, exacerbating the original degree of imbalance. We call this phenomenon as ``tail-to-head (T2H)'' noise. T2H noise severely degrades model performance by polluting the head classes and forcing the model to learn the tail samples as head. To address this challenge, we investigate the dynamic misleading process of the nosiy labels and propose a novel method called Disentangling and Unlearning for Long-tailed and Label-noisy data (DULL). It first employs the Inner-Feature Disentangling (IFD) to disentangle feature internally. Based on this, the Inner-Feature Partial Unlearning (IFPU) is then applied to weaken and unlearn incorrect feature regions correlated to wrong classes. This method prevents the model from being misled by noisy labels, enhancing the model's robustness against noise. To provide a controlled experimental environment, we further propose a new noise addition algorithm to simulate T2H noise. Extensive experiments on both simulated and real-world datasets demonstrate the effectiveness of our proposed method.

cs.LG↗

arXiv2025

Can Large Language Models Help Experimental Design for Causal Discovery?

Designing proper experiments and selecting optimal intervention targets is a longstanding problem in scientific or causal discovery. Identifying the underlying causal structure from observational data alone is inherently difficult. Obtaining interventional data, on the other hand, is crucial to causal discovery, yet it is usually expensive and time-consuming to gather sufficient interventional data to facilitate causal discovery. Previous approaches commonly utilize uncertainty or gradient signals to determine the intervention targets. However, numerical-based approaches may yield suboptimal results due to the inaccurate estimation of the guiding signals at the beginning when with limited interventional data. In this work, we investigate a different approach, whether we can leverage Large Language Models (LLMs) to assist with the intervention targeting in causal discovery by making use of the rich world knowledge about the experimental design in LLMs. Specifically, we present Large Language Model Guided Intervention Targeting (LeGIT) -- a robust framework that effectively incorporates LLMs to augment existing numerical approaches for the intervention targeting in causal discovery. Across 4 realistic benchmark scales, LeGIT demonstrates significant improvements and robustness over existing methods and even surpasses humans, which demonstrates the usefulness of LLMs in assisting with experimental design for scientific discovery.

cs.AI↗

arXiv2025

Atomas: Hierarchical Alignment on Molecule-Text for Unified Molecule Understanding and Generation

Molecule-and-text cross-modal representation learning has emerged as a promising direction for enhancing the quality of molecular representation, thereby improving performance in various scientific fields. However, most approaches employ a global alignment approach to learn the knowledge from different modalities that may fail to capture fine-grained information, such as molecule-and-text fragments and stereoisomeric nuances, which is crucial for downstream tasks. Furthermore, it is incapable of modeling such information using a similar global alignment strategy due to the lack of annotations about the fine-grained fragments in the existing dataset. In this paper, we propose Atomas, a hierarchical molecular representation learning framework that jointly learns representations from SMILES strings and text. We design a Hierarchical Adaptive Alignment model to automatically learn the fine-grained fragment correspondence between two modalities and align these representations at three semantic levels. Atomas's end-to-end training framework supports understanding and generating molecules, enabling a wider range of downstream tasks. Atomas achieves superior performance across 12 tasks on 11 datasets, outperforming 11 baseline models thus highlighting the effectiveness and versatility of our method. Scaling experiments further demonstrate Atomas's robustness and scalability. Moreover, visualization and qualitative analysis, validated by human experts, confirm the chemical relevance of our approach. Codes are released on https://github.com/yikunpku/Atomas.

q-bio.QM↗

arXiv2025

Rethinking LLM Unlearning Objectives: A Gradient Perspective and Go Beyond

Large language models (LLMs) should undergo rigorous audits to identify potential risks, such as copyright and privacy infringements. Once these risks emerge, timely updates are crucial to remove undesirable responses, ensuring legal and safe model usage. It has spurred recent research into LLM unlearning, focusing on erasing targeted undesirable knowledge without compromising the integrity of other, non-targeted responses. Existing studies have introduced various unlearning objectives to pursue LLM unlearning without necessitating complete retraining. However, each of these objectives has unique properties, and no unified framework is currently available to comprehend them thoroughly. To fill the gap, we propose a toolkit of the gradient effect (G-effect), quantifying the impacts of unlearning objectives on model performance from a gradient perspective. A notable advantage is its broad ability to detail the unlearning impacts from various aspects across instances, updating steps, and LLM layers. Accordingly, the G-effect offers new insights into identifying drawbacks of existing unlearning objectives, further motivating us to explore a series of new solutions for their mitigation and improvements. Finally, we outline promising directions that merit further studies, aiming at contributing to the community to advance this important field.

cs.LG↗

arXiv2025

Towards Effective Evaluations and Comparisons for LLM Unlearning Methods

The imperative to eliminate undesirable data memorization underscores the significance of machine unlearning for large language models (LLMs). Recent research has introduced a series of promising unlearning methods, notably boosting the practical significance of the field. Nevertheless, adopting a proper evaluation framework to reflect the true unlearning efficacy is also essential yet has not received adequate attention. This paper seeks to refine the evaluation of LLM unlearning by addressing two key challenges -- a) the robustness of evaluation metrics and b) the trade-offs between competing goals. The first challenge stems from findings that current metrics are susceptible to various red teaming scenarios. It indicates that they may not reflect the true extent of knowledge retained by LLMs but rather tend to mirror superficial model behaviors, thus prone to attacks. We address this issue by devising and assessing a series of candidate metrics, selecting the most robust ones under various types of attacks. The second challenge arises from the conflicting goals of eliminating unwanted knowledge while retaining those of others. This trade-off between unlearning and retention often fails to conform the Pareto frontier, rendering it subtle to compare the efficacy between methods that excel only in either unlearning or retention. We handle this issue by proposing a calibration method that can restore the original performance on non-targeted data after unlearning, thereby allowing us to focus exclusively on assessing the strength of unlearning. Our evaluation framework notably enhances the effectiveness when assessing and comparing various LLM unlearning methods, further allowing us to benchmark existing works, identify their proper hyper-parameters, and explore new tricks to enhance their practical efficacy.

cs.LG↗

arXiv2025

Accurate Forgetting for Heterogeneous Federated Continual Learning

Recent years have witnessed a burgeoning interest in federated learning (FL). However, the contexts in which clients engage in sequential learning remain under-explored. Bridging FL and continual learning (CL) gives rise to a challenging practical problem: federated continual learning (FCL). Existing research in FCL primarily focuses on mitigating the catastrophic forgetting issue of continual learning while collaborating with other clients. We argue that the forgetting phenomena are not invariably detrimental. In this paper, we consider a more practical and challenging FCL setting characterized by potentially unrelated or even antagonistic data/tasks across different clients. In the FL scenario, statistical heterogeneity and data noise among clients may exhibit spurious correlations which result in biased feature learning. While existing CL strategies focus on a complete utilization of previous knowledge, we found that forgetting biased information is beneficial in our study. Therefore, we propose a new concept accurate forgetting (AF) and develop a novel generative-replay method~\method~which selectively utilizes previous knowledge in federated networks. We employ a probabilistic framework based on a normalizing flow model to quantify the credibility of previous knowledge. Comprehensive experiments affirm the superiority of our method over baselines.

cs.LG↗

arXiv2025

Fast and Accurate Blind Flexible Docking

Molecular docking that predicts the bound structures of small molecules (ligands) to their protein targets, plays a vital role in drug discovery. However, existing docking methods often face limitations: they either overlook crucial structural changes by assuming protein rigidity or suffer from low computational efficiency due to their reliance on generative models for structure sampling. To address these challenges, we propose FABFlex, a fast and accurate regression-based multi-task learning model designed for realistic blind flexible docking scenarios, where proteins exhibit flexibility and binding pocket sites are unknown (blind). Specifically, FABFlex's architecture comprises three specialized modules working in concert: (1) A pocket prediction module that identifies potential binding sites, addressing the challenges inherent in blind docking scenarios. (2) A ligand docking module that predicts the bound (holo) structures of ligands from their unbound (apo) states. (3) A pocket docking module that forecasts the holo structures of protein pockets from their apo conformations. Notably, FABFlex incorporates an iterative update mechanism that serves as a conduit between the ligand and pocket docking modules, enabling continuous structural refinements. This approach effectively integrates the three subtasks of blind flexible docking-pocket identification, ligand conformation prediction, and protein flexibility modeling-into a unified, coherent framework. Extensive experiments on public benchmark datasets demonstrate that FABFlex not only achieves superior effectiveness in predicting accurate binding modes but also exhibits a significant speed advantage (208 $\times$) compared to existing state-of-the-art methods. Our code is released at https://github.com/tmlr-group/FABFlex.

q-bio.QM↗

arXiv2025

One-shot Federated Learning Methods: A Practical Guide

One-shot Federated Learning (OFL) is a distributed machine learning paradigm that constrains client-server communication to a single round, addressing privacy and communication overhead issues associated with multiple rounds of data exchange in traditional Federated Learning (FL). OFL demonstrates the practical potential for integration with future approaches that require collaborative training models, such as large language models (LLMs). However, current OFL methods face two major challenges: data heterogeneity and model heterogeneity, which result in subpar performance compared to conventional FL methods. Worse still, despite numerous studies addressing these limitations, a comprehensive summary is still lacking. To address these gaps, this paper presents a systematic analysis of the challenges faced by OFL and thoroughly reviews the current methods. We also offer an innovative categorization method and analyze the trade-offs of various techniques. Additionally, we discuss the most promising future directions and the technologies that should be integrated into the OFL field. This work aims to provide guidance and insights for future research.

cs.LG↗

arXiv2025

Instance-dependent Early Stopping

In machine learning practice, early stopping has been widely used to regularize models and can save computational costs by halting the training process when the model's performance on a validation set stops improving. However, conventional early stopping applies the same stopping criterion to all instances without considering their individual learning statuses, which leads to redundant computations on instances that are already well-learned. To further improve the efficiency, we propose an Instance-dependent Early Stopping (IES) method that adapts the early stopping mechanism from the entire training set to the instance level, based on the core principle that once the model has mastered an instance, the training on it should stop. IES considers an instance as mastered if the second-order differences of its loss value remain within a small range around zero. This offers a more consistent measure of an instance's learning status compared with directly using the loss value, and thus allows for a unified threshold to determine when an instance can be excluded from further backpropagation. We show that excluding mastered instances from backpropagation can increase the gradient norms, thereby accelerating the decrease of the training loss and speeding up the training process. Extensive experiments on benchmarks demonstrate that IES method can reduce backpropagation instances by 10%-50% while maintaining or even slightly improving the test accuracy and transfer learning performance of a model.

cs.LG↗

arXiv2025

Less is More: One-shot Subgraph Reasoning on Large-scale Knowledge Graphs

To deduce new facts on a knowledge graph (KG), a link predictor learns from the graph structure and collects local evidence to find the answer to a given query. However, existing methods suffer from a severe scalability problem due to the utilization of the whole KG for prediction, which hinders their promise on large scale KGs and cannot be directly addressed by vanilla sampling methods. In this work, we propose the one-shot-subgraph link prediction to achieve efficient and adaptive prediction. The design principle is that, instead of directly acting on the whole KG, the prediction procedure is decoupled into two steps, i.e., (i) extracting only one subgraph according to the query and (ii) predicting on this single, query dependent subgraph. We reveal that the non-parametric and computation-efficient heuristics Personalized PageRank (PPR) can effectively identify the potential answers and supporting evidence. With efficient subgraph-based prediction, we further introduce the automated searching of the optimal configurations in both data and model spaces. Empirically, we achieve promoted efficiency and leading performances on five large-scale benchmarks. The code is publicly available at: https://github.com/tmlr-group/one-shot-subgraph.

cs.LG↗