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Deep Learning · Large Language Models

Junkang Wu, Yuexiang Xie, Zhengyi Yang, Jiancan Wu, Jiawei Chen, Jinyang Gao, Bolin Ding, Xiang Wang, Xiangnan He

This study addresses the challenge of noise in training datasets for Direct Preference Optimization (DPO), a method for aligning Large Language Models (LLMs) with human preferences. We categorize noise into pointwise noise, which includes low-quality data points, and pairwise noise, which encompasses erroneous data pair associations that affect preference rankings. Utilizing Distributionally Robust Optimization (DRO), we enhance DPO's resilience to these types of noise. Our theoretical insights reveal that DPO inherently embeds DRO principles, conferring robustness to pointwise noise, with the regularization coefficient $\beta$ playing a critical role in its noise resistance. Extending this framework, we introduce Distributionally Robustifying DPO (Dr. DPO), which integrates pairwise robustness by optimizing against worst-case pairwise scenarios. The novel hyperparameter $\beta'$ in Dr. DPO allows for fine-tuned control over data pair reliability, providing a strategic balance between exploration and exploitation in noisy training environments. Empirical evaluations demonstrate that Dr. DPO substantially improves the quality of generated text and response accuracy in preference datasets, showcasing enhanced performance in both noisy and noise-free settings.

Théo Uscidda, Luca Eyring, Karsten Roth, Fabian Theis, Zeynep Akata, marco cuturi

Learning disentangled representations from unlabelled data is a fundamental challenge in machine learning. Solving it may unlock other problems, such as generalization, interpretability, or fairness. Although remarkably challenging to solve in theory, disentanglement is often achieved in practice through prior matching. Furthermore, recent works have shown that prior matching approaches can be enhanced by leveraging geometrical considerations, e.g., by learning representations that preserve geometric features of the data, such as distances or angles between points. However, matching the prior while preserving geometric features is challenging, as a mapping that *fully* preserves these features while aligning the data distribution with the prior does not exist in general. To address these challenges, we introduce a novel approach to disentangled representation learning based on quadratic optimal transport. We formulate the problem using Gromov-Monge maps that transport one distribution onto another with minimal distortion of predefined geometric features, preserving them *as much as can be achieved*. To compute such maps, we propose the Gromov-Monge-Gap (GMG), a regularizer quantifying whether a map moves a reference distribution with minimal geometry distortion. We demonstrate the effectiveness of our approach for disentanglement across four standard benchmarks, outperforming other methods leveraging geometric considerations.

Applications · Computer Vision

Yanzhe Chen, Zhiwen Yang, Jinglin Xu, Yuxin Peng

Multi-Turn Composed Image Retrieval (MTCIR) addresses a real-world scenario where users iteratively refine retrieval results by providing additional information until a target meeting all their requirements is found. Existing methods primarily achieve MTCIR through a "multiple single-turn" paradigm, wherein methods incorrectly converge on shortcuts that only utilize the most recent turn's image, ignoring attributes from historical turns. Consequently, retrieval failures occur when modification requests involve historical information. We argue that explicitly incorporating historical information into the modified text is crucial to addressing this issue. To this end, we build a new retrospective-based MTCIR dataset, **FashionMT**, wherein modification demands are highly associated with historical turns. We also propose a Multi-turn Aggregation-Iteration (**MAI**) model, emphasizing efficient aggregation of multimodal semantics and optimization of information propagation in multi-turn retrieval. Specifically, we propose a new Two-stage Semantic Aggregation (TSA) paradigm coupled with a Cyclic Combination Loss (CCL), achieving improved semantic consistency and modality alignment by progressively interacting the reference image with its caption and the modified text. In addition, we design a Multi-turn Iterative Optimization (MIO) mechanism that dynamically selects representative tokens and reduces redundancy during multi-turn iterations. Extensive experiments demonstrate that the proposed MAI model achieves substantial improvements over state-of-the-art methods.

Deep Learning · Theory

Viet-Hoang Tran, Minh-Khoi Nguyen-Nhat, Trang Pham, Thanh Chu, Tam Le, Tan Nguyen

To overcome computational challenges of Optimal Transport (OT), several variants of Sliced Wasserstein (SW) has been developed in the literature. These approaches exploit the closed-form expression of the univariate OT by projecting measures onto one-dimensional lines. However, projecting measures onto low-dimensional spaces can lead to a loss of topological information. Tree-Sliced Wasserstein distance on Systems of Lines (TSW-SL) has emerged as a promising alternative that replaces these lines with a more intricate structure called tree systems. The tree structures enhance the ability to capture topological information of the metric while preserving computational efficiency. However, at the core of TSW-SL, the splitting maps, which serve as the mechanism for pushing forward measures onto tree systems, focus solely on the position of the measure supports while disregarding the projecting domains. Moreover, the specific splitting map used in TSW-SL leads to a metric that is not invariant under Euclidean transformations, a typically expected property for OT on Euclidean space. In this work, we propose a novel class of splitting maps that generalizes the existing one studied in TSW-SL enabling the use of all positional information from input measures, resulting in a novel Distance-based Tree-Sliced Wasserstein (*Db-TSW*) distance. In addition, we introduce a simple tree sampling process better suited for Db-TSW, leading to an efficient GPU-friendly implementation for tree systems, similar to the original SW. We also provide a comprehensive theoretical analysis of proposed class of splitting maps to verify the injectivity of the corresponding Radon Transform, and demonstrate that Db-TSW is an Euclidean invariant metric. We empirically show that Db-TSW significantly improves accuracy compared to recent SW variants while maintaining low computational cost via a wide range of experiments on gradient flows, image style transfer, and generative models.

Deep Learning · Theory

Viet-Hoang Tran, Thanh Chu, Minh-Khoi Nguyen-Nhat, Trang Pham, Tam Le, Tan Nguyen

Sliced Optimal Transport (OT) simplifies the OT problem in high-dimensional spaces by projecting supports of input measures onto one-dimensional lines, then exploiting the closed-form expression of the univariate OT to reduce the computational burden of OT. Recently, the Tree-Sliced method has been introduced to replace these lines with more intricate structures, known as tree systems. This approach enhances the ability to capture topological information of integration domains in Sliced OT while maintaining low computational cost. Inspired by this approach, in this paper, we present an adaptation of tree systems on OT problem for measures supported on a sphere. As counterpart to the Radon transform variant on tree systems, we propose a novel spherical Radon transform, with a new integration domain called spherical trees. By leveraging this transform and exploiting the spherical tree structures, we derive closed-form expressions for OT problems on the sphere. Consequently, we obtain an efficient metric for measures on the sphere, named Spherical Tree-Sliced Wasserstein (STSW) distance. We provide an extensive theoretical analysis to demonstrate the topology of spherical trees, the well-definedness and injectivity of our Radon transform variant, which leads to an orthogonally invariant distance between spherical measures. Finally, we conduct a wide range of numerical experiments, including gradient flows and self-supervised learning, to assess the performance of our proposed metric, comparing it to recent benchmarks.

Applications · Computer Vision

Zhenyu Yang, Yuhang Hu, Zemin Du, Dizhan Xue, Shengsheng Qian, Jiahong Wu, Fan Yang, Weiming Dong, Changsheng Xu

Despite the significant advancements of Large Vision-Language Models (LVLMs) on established benchmarks, there remains a notable gap in suitable evaluation regarding their applicability in the emerging domain of long-context streaming video understanding. Current benchmarks for video understanding typically emphasize isolated single-instance text inputs and fail to evaluate the capacity to sustain temporal reasoning throughout the entire duration of video streams. To address these limitations, we introduce SVBench, a pioneering benchmark with temporal multi-turn question-answering chains specifically designed to thoroughly assess the capabilities of streaming video understanding of current LVLMs. We design a semi-automated annotation pipeline to obtain 49,979 Question-Answer (QA) pairs of 1,353 streaming videos, which includes generating QA chains that represent a series of consecutive multi-turn dialogues over video segments and constructing temporal linkages between successive QA chains. Our experimental results, obtained from 14 models in dialogue and streaming evaluations, reveal that while the closed-source GPT-4o outperforms others, most open-source LVLMs struggle with long-context streaming video understanding. We also construct a StreamingChat model, which significantly outperforms open-source LVLMs on our SVBench and achieves comparable performance on diverse vision-language benchmarks. We expect SVBench to advance the research of streaming video understanding by providing a comprehensive and in-depth analysis of current LVLMs. Our benchmark and model can be accessed at https://yzy-bupt.github.io/SVBench.

Applications · Computer Vision

Yuqi Lin, Hengjia Li, Wenqi Shao, Zheng Yang, Jun Zhao, Xiaofei He, Ping Luo, Kaipeng Zhang

In this paper, we explore a principal way to enhance the quality of widely pre-existing coarse masks, enabling them to serve as reliable training data for segmentation models to reduce the annotation cost. In contrast to prior refinement techniques that are tailored to specific models or tasks in a close-world manner, we propose SAMRefiner, a universal and efficient approach by adapting SAM to the mask refinement task. The core technique of our model is the noise-tolerant prompting scheme. Specifically, we introduce a multi-prompt excavation strategy to mine diverse input prompts for SAM (\ie, distance-guided points, context-aware elastic bounding boxes, and Gaussian-style masks) from initial coarse masks. These prompts can collaborate with each other to mitigate the effect of defects in coarse masks. In particular, considering the difficulty of SAM to handle the multi-object case in semantic segmentation, we introduce a split-then-merge (STM) pipeline. Additionally, we extend our method to SAMRefiner++ by introducing an additional IoU adaption step to further boost the performance of the generic SAMRefiner on the target dataset. This step is self-boosted and requires no additional annotation. The proposed framework is versatile and can flexibly cooperate with existing segmentation methods. We evaluate our mask framework on a wide range of benchmarks under different settings, demonstrating better accuracy and efficiency. SAMRefiner holds significant potential to expedite the evolution of refinement tools. Our code is available at https://github.com/linyq2117/SAMRefiner.

Social Aspects · Fairness, Equity, Justice and Safety

Leander Girrbach, Stephan Alaniz, Yiran Huang, trevor darrell, Zeynep Akata

Pre-trained large language models (LLMs) have been reliably integrated with visual input for multimodal tasks. The widespread adoption of instruction-tuned image-to-text vision-language assistants (VLAs) like LLaVA and InternVL necessitates evaluating gender biases. We study gender bias in 22 popular open-source VLAs with respect to personality traits, skills, and occupations. Our results show that VLAs replicate human biases likely present in the data, such as real-world occupational imbalances. Similarly, they tend to attribute more skills and positive personality traits to women than to men, and we see a consistent tendency to associate negative personality traits with men. To eliminate the gender bias in these models, we find that fine-tuning-based debiasing methods achieve the best trade-off between debiasing and retaining performance on downstream tasks. We argue for pre-deploying gender bias assessment in VLAs and motivate further development of debiasing strategies to ensure equitable societal outcomes. Code is available at https://github.com/ExplainableML/vla-gender-bias.

Probabilistic Methods · Bayesian Models and Methods

Ola Rønning, Eric Nalisnick, Christophe Ley, Padhraic Smyth, Thomas Hamelryck

Stein variational gradient descent (SVGD) (Liu & Wang, 2016) performs approximate Bayesian inference by representing the posterior with a set of particles.However, SVGD suffers from variance collapse, i.e. poor predictions due to underestimating uncertainty (Ba et al., 2021), even for moderately-dimensional modelssuch as small Bayesian neural networks (BNNs). To address this issue, we generalize SVGD by letting each particle parameterize a component distribution ina mixture model. Our method, Stein Mixture Inference (SMI), optimizes a lowerbound to the evidence (ELBO) and introduces user-specified guides parameterizedby particles. SMI extends the Nonlinear SVGD framework (Wang & Liu, 2019) tothe case of variational Bayes. SMI effectively avoids variance collapse, judging bya previously described test developed for this purpose, and performs well on standard data sets. In addition, SMI requires considerably fewer particles than SVGDto accurately estimate uncertainty for small BNNs. The synergistic combination ofNSVGD, ELBO optimization and user-specified guides establishes a promisingapproach towards variational Bayesian inference in the case of tall and wide data.

Optimization · Everything Else

Liang Sun, Yang Zhang, Weizhao He, Jiajun Wen, Linlin Shen, Weicheng Xie

While backpropagation effectively trains models, it presents challenges related to bio-plausibility, resulting in high memory demands and limited parallelism. Recently, Hinton (2022) proposed the Forward-Forward (FF) algorithm for high-parallel local updates. FF leverages squared sums as the local update target, termed goodness, and decouples goodness by normalizing the vector length to extract new features. However, this design encounters issues with feature scaling and deactivated neurons, limiting its application mainly to shallow networks. This paper proposes a novel goodness design utilizing **layer normalization** and **mean goodness** to overcome these challenges, demonstrating performance improvements even in 17-layer CNNs. Experiments on CIFAR-10, MNIST, and Fashion-MNIST show significant advantages over existing FF-based algorithms, highlighting the potential of FF in deep models. Furthermore, the model parallel strategy is proposed to achieve highly efficient training based on the property of local updates.

Miscellaneous Aspects of Machine Learning · Representation Learning

Shuchen Wu, Mirko Thalmann, Peter Dayan, Zeynep Akata, Eric Schulz

Humans excel at learning abstract patterns across different sequences, filtering outirrelevant details, and transferring these generalized concepts to new sequences.In contrast, many sequence learning models lack the ability to abstract, whichleads to memory inefficiency and poor transfer. We introduce a non-parametrichierarchical variable learning model (HVM) that learns chunks from sequencesand abstracts contextually similar chunks as variables. HVM efficiently organizesmemory while uncovering abstractions, leading to compact sequence representations.When learning on language datasets such as babyLM, HVM learns a more efficientdictionary than standard compression algorithms such as Lempel-Ziv. In a sequencerecall task requiring the acquisition and transfer of variables embedded in sequences,we demonstrate HVM’s sequence likelihood correlates with human recall times. Incontrast, large language models (LLMs) struggle to transfer abstract variables aseffectively as humans. From HVM’s adjustable layer of abstraction, we demonstratethat the model realizes a precise trade-off between compression and generalization.Our work offers a cognitive model that captures the learning and transfer of abstractrepresentations in human cognition and differentiates itself from LLMs.

Reinforcement Learning · Deep RL

Hung Le, Dung Nguyen, Kien Do, Sunil Gupta, Svetha Venkatesh

Effective decision-making in partially observable environments demands robust memory management. Despite their success in supervised learning, current deep-learning memory models struggle in reinforcement learning environments that are partially observable and long-term. They fail to efficiently capture relevant past information, adapt flexibly to changing observations, and maintain stable updates over long episodes. We theoretically analyze the limitations of existing memory models within a unified framework and introduce the Stable Hadamard Memory, a novel memory model for reinforcement learning agents. Our model dynamically adjusts memory by erasing no longer needed experiences and reinforcing crucial ones computationally efficiently. To this end, we leverage the Hadamard product for calibrating and updating memory, specifically designed to enhance memory capacity while mitigating numerical and learning challenges. Our approach significantly outperforms state-of-the-art memory-based methods on challenging partially observable benchmarks, such as meta-reinforcement learning, long-horizon credit assignment, and POPGym, demonstrating superior performance in handling long-term and evolving contexts.

Applications · Health

Lehan Wang, Haonan Wang, Honglong Yang, Jiaji Mao, Zehong Yang, Jun Shen, Xiaomeng Li

Several medical Multimodal Large Languange Models (MLLMs) have been developed to address tasks involving visual images with textual instructions across various medical modalities, achieving impressive results. Most current medical generalist models are region-agnostic, treating the entire image as a holistic representation. However, they struggle to identify which specific regions they are focusing on when generating a sentence.To mimic the behavior of doctors, who typically begin by reviewing the entire image before concentrating on specific regions for a thorough evaluation, we aim to enhance the capability of medical MLLMs in understanding anatomical regions within entire medical scans.To achieve it, we first formulate \textbf{Region-Centric tasks} and construct a \textbf{large-scale dataset, MedRegInstruct,} to incorporate regional information into training. Combining our collected dataset with other medical multimodal corpora for training, we propose a \textbf{Region-Aware medical MLLM, MedRegA}, which is the first bilingual generalist medical AI system to simultaneously handle image-level and region-level medical vision-language tasks across a broad range of modalities. Our MedRegA not only enables three region-centric tasks, but also achieves the best performance for visual question answering, report generation and medical image classification over 8 modalities, showcasing significant versatility. Experiments demonstrate that our model can not only accomplish powerful performance across various medical vision-language tasks in bilingual settings, but also recognize and detect structures in multimodal medical scans, boosting the interpretability and user interactivity of medical MLLMs. The codes and model will be made publicly available.

Optimization · Optimization and Learning under Uncertainty

Dan Steinberg, Rafael Oliveira, Cheng Soon Ong, Edwin Bonilla

We develop VSD, a method for conditioning a generative model of discrete, combinatorial designs on a rare desired class by efficiently evaluating a black-box (e.g. experiment, simulation) in a batch sequential manner. We call this task active generation; we formalize active generation's requirements and desiderata, and formulate a solution via variational inference. VSD uses off-the-shelf gradient based optimization routines, can learn powerful generative models for desirable designs, and can take advantage of scalable predictive models. We derive asymptotic convergence rates for learning the true conditional generative distribution of designs with certain configurations of our method. After illustrating the generative model on images, we empirically demonstrate that VSD can outperform existing baseline methods on a set of real sequence-design problems in various protein and DNA/RNA engineering tasks.

Massimo Bini, Leander Girrbach, Zeynep Akata

Parameter-Efficient FineTuning (PEFT) methods have recently gained significant popularity thanks to the widespread availability of large-scale pretrained models. These methods allow for quick adaptation to downstream tasks with minimal computational cost. However, popular finetuning methods such as LoRA exhibit limited robustness when it comes to hyperparameter choices or extended training regimes, preventing optimal out-of-the-box performance. In contrast, bounded approaches, such as ETHER, provide greater robustness but are limited to extremely low-rank adaptations and fixed-strength transformations, reducing their adaptation expressive power. In this work, we propose Decoupled Low-rank Adaptation (DeLoRA), a novel finetuning method that normalizes and scales learnable low-rank matrices. By bounding the distance of the transformation, DeLoRA effectively decouples the angular learning from the adaptation strength, enhancing robustness without compromising performance. Through evaluations on subject-driven image generation, natural language understanding, and instruction tuning, we show that DeLoRA matches or surpasses performance of competing PEFT methods, while exhibiting stronger robustness. Code is available at https://github.com/ExplainableML/DeLoRA.

Reinforcement Learning · Deep RL

Maxime Burchi, Radu Timofte

The DreamerV3 algorithm recently obtained remarkable performance across diverse environment domains by learning an accurate world model based on Recurrent Neural Networks (RNNs). Following the success of model-based reinforcement learning algorithms and the rapid adoption of the Transformer architecture for its superior training efficiency and favorable scaling properties, recent works such as STORM have proposed replacing RNN-based world models with Transformer-based world models using masked self-attention. However, despite the improved training efficiency of these methods, their impact on performance remains limited compared to the Dreamer algorithm, struggling to learn competitive Transformer-based world models. In this work, we show that the next state prediction objective adopted in previous approaches is insufficient to fully exploit the representation capabilities of Transformers. We propose to extend world model predictions to longer time horizons by introducing TWISTER (Transformer-based World model wIth contraSTivE Representations), a world model using action-conditioned Contrastive Predictive Coding to learn high-level temporal feature representations and improve the agent performance. TWISTER achieves a human-normalized mean score of 162% on the Atari 100k benchmark, setting a new record among state-of-the-art methods that do not employ look-ahead search. We release our code at https://github.com/burchim/TWISTER.

Applications · Genetics, Cell Biology, Health, etc

Zhao Yang, Bing Su, Chuan Cao, Ji-Rong Wen

$\textit{Cis}$-regulatory elements (CREs), such as promoters and enhancers, are relatively short DNA sequences that directly regulate gene expression. The fitness of CREs, measured by their ability to modulate gene expression, highly depends on the nucleotide sequences, especially specific motifs known as transcription factor binding sites (TFBSs). Designing high-fitness CREs is crucial for therapeutic and bioengineering applications. Current CRE design methods are limited by two major drawbacks: (1) they typically rely on iterative optimization strategies that modify existing sequences and are prone to local optima, and (2) they lack the guidance of biological prior knowledge in sequence optimization. In this paper, we address these limitations by proposing a generative approach that leverages reinforcement learning (RL) to fine-tune a pre-trained autoregressive (AR) model. Our method incorporates data-driven biological priors by deriving computational inference-based rewards that simulate the addition of activator TFBSs and removal of repressor TFBSs, which are then integrated into the RL process. We evaluate our method on promoter design tasks in two yeast media conditions and enhancer design tasks for three human cell types, demonstrating its ability to generate high-fitness CREs while maintaining sequence diversity. The code is available at https://github.com/yangzhao1230/TACO.

Miscellaneous Aspects of Machine Learning · General Machine Learning Techniques

Gregor Bachmann, Sotiris Anagnostidis, Albert Pumarola, Markos Georgopoulos, Artsiom Sanakoyeu, Yuming Du, Edgar Schoenfeld, Ali Thabet, Jonas Kohler

The performance of large language models (LLMs) is closely linked to their underlying size, leading to ever-growing networks and hence slower inference. Speculative decoding has been proposed as a technique to accelerate autoregressive generation, leveraging a fast draft model to propose candidate tokens, which are then verified in parallel based on their likelihood under the target model. While this approach guarantees to reproduce the target output, it incurs a substantial penalty: many high-quality draft tokens are rejected, even when they represent objectively valid continuations. Indeed, we show that even powerful draft models such as GPT-4o, as well as human text cannot achieve high acceptance rates under the standard verification scheme. This severely limits the speedup potential of current speculative decoding methods, as an early rejection becomes overwhelmingly likely when solely relying on alignment of draft and target.We thus ask the following question: Can we adapt verification to recognize correct, but non-aligned replies? To this end, we draw inspiration from the LLM-as-a-judge framework, which demonstrated that LLMs are able to rate answers in a versatile way. We carefully design a dataset coined TokenCourt to elicit the same capability in the target model by training a compact module on top of the embeddings to produce ``judgements" of the current continuation. We showcase our strategy on the Llama-3.1 family, where our 8B/405B-Judge achieves a speedup of $9\times$ over Llama-405B, while maintaining its quality on a large range of benchmarks. These benefits remain present even in optimized inference frameworks, where our method reaches up to $141$ tokens/s for 8B/70B-Judge and $129$ tokens/s for 8B/405B on $2$ and $8$ H100s respectively.

Probabilistic Methods · Monte Carlo and Sampling Methods

Timofei Gritsaev, Nikita Morozov, Sergey Samsonov, Daniil Tiapkin

Generative Flow Networks (GFlowNets) are a family of generative models that learn to sample objects with probabilities proportional to a given reward function. The key concept behind GFlowNets is the use of two stochastic policies: a forward policy, which incrementally constructs compositional objects, and a backward policy, which sequentially deconstructs them. Recent results show a close relationship between GFlowNet training and entropy-regularized reinforcement learning (RL) problems with a particular reward design. However, this connection applies only in the setting of a fixed backward policy, which might be a significant limitation. As a remedy to this problem, we introduce a simple backward policy optimization algorithm that involves direct maximization of the value function in an entropy-regularized Markov Decision Process (MDP) over intermediate rewards. We provide an extensive experimental evaluation of the proposed approach across various benchmarks in combination with both RL and GFlowNet algorithms and demonstrate its faster convergence and mode discovery in complex environments.

Ziyu Zhao, tao shen, Didi Zhu, Zexi Li, Jing Su, Xuwu Wang, Fei Wu

Low-Rank Adaptation (LoRA) has emerged as a popular technique for fine-tuning large language models (LLMs) to various domains due to its modular design and widespread availability on platforms like Huggingface. This modularity has sparked interest in combining multiple LoRAs to significantly enhance LLM capabilities. However, existing methods for LoRA composition primarily focus on task-specific adaptations that require additional training, and current model merging techniques often fail to fully leverage LoRA's modular nature, leading to parameter interference and performance degradation.In this paper, we explore the possibility of disassembling and reassembling multiple LoRAs at a finer granularity, much like assembling LEGO blocks. We introduce the concept of Minimal Semantic Units (MSUs), where the parameters corresponding to each rank in LoRA function as independent units. These MSUs exhibit properties such as permutation invariance and concatenation-summation equivalence, allowing for flexible combinations to form new LoRAs. Building on these insights, we propose the LoRA-LEGO framework. This framework conducts rank-wise parameter clustering by grouping MSUs from different LoRAs into $k$ clusters. The centroid of each cluster serves as a representative MSU, enabling the assembly of a merged LoRA with an adjusted rank of $k$. Additionally, we apply a dual reweighting strategy to optimize the scale of the merged LoRA. Experiments across various benchmarks demonstrate that our method outperforms existing approaches in LoRA merging.