Compression with Global Guidance: Towards Training-free High-Resolution MLLMs Acceleration

Multimodal large language models (MLLMs) have attracted considerable attention due to their exceptional performance in visual content understanding and reasoning. However, their inference efficiency has been a notable concern, as the increasing length of multimodal contexts leads to quadratic complexity. Token compression techniques, which reduce the number of visual tokens, have demonstrated their effectiveness in reducing computational costs. Yet, these approaches have struggled to keep pace with the rapid advancements in MLLMs, especially the AnyRes strategy in the context of high-resolution image understanding. In this paper, we propose a novel token compression method, GlobalCom$^2$, tailored for high-resolution MLLMs that receive both the thumbnail and multiple crops. GlobalCom$^2$ treats the tokens derived from the thumbnail as the ``commander'' of the entire token compression process, directing the allocation of retention ratios and the specific compression for each crop. In this way, redundant tokens are eliminated while important local details are adaptively preserved to the highest extent feasible. Empirical results across 10 benchmarks reveal that GlobalCom$^2$ achieves an optimal balance between performance and efficiency, and consistently outperforms state-of-the-art token compression methods with LLaVA-NeXT-7B/13B models. Our code is released at \url{https://github.com/xuyang-liu16/GlobalCom2}.

Token Pruning for Caching Better: 9 Times Acceleration on Stable Diffusion for Free

Stable Diffusion has achieved remarkable success in the field of text-to-image generation, with its powerful generative capabilities and diverse generation results making a lasting impact. However, its iterative denoising introduces high computational costs and slows generation speed, limiting broader adoption. The community has made numerous efforts to reduce this computational burden, with methods like feature caching attracting attention due to their effectiveness and simplicity. Nonetheless, simply reusing features computed at previous timesteps causes the features across adjacent timesteps to become similar, reducing the dynamics of features over time and ultimately compromising the quality of generated images. In this paper, we introduce a dynamics-aware token pruning (DaTo) approach that addresses the limitations of feature caching. DaTo selectively prunes tokens with lower dynamics, allowing only high-dynamic tokens to participate in self-attention layers, thereby extending feature dynamics across timesteps. DaTo combines feature caching with token pruning in a training-free manner, achieving both temporal and token-wise information reuse. Applied to Stable Diffusion on the ImageNet, our approach delivered a 9$\times$ speedup while reducing FID by 0.33, indicating enhanced image quality. On the COCO-30k, we observed a 7$\times$ acceleration coupled with a notable FID reduction of 2.17.

Accelerating Diffusion Transformers with Dual Feature Caching

Diffusion Transformers (DiT) have become the dominant methods in image and video generation yet still suffer substantial computational costs. As an effective approach for DiT acceleration, feature caching methods are designed to cache the features of DiT in previous timesteps and reuse them in the next timesteps, allowing us to skip the computation in the next timesteps. However, on the one hand, aggressively reusing all the features cached in previous timesteps leads to a severe drop in generation quality. On the other hand, conservatively caching only the features in the redundant layers or tokens but still computing the important ones successfully preserves the generation quality but results in reductions in acceleration ratios. Observing such a tradeoff between generation quality and acceleration performance, this paper begins by quantitatively studying the accumulated error from cached features. Surprisingly, we find that aggressive caching does not introduce significantly more caching errors in the caching step, and the conservative feature caching can fix the error introduced by aggressive caching. Thereby, we propose a dual caching strategy that adopts aggressive and conservative caching iteratively, leading to significant acceleration and high generation quality at the same time. Besides, we further introduce a V-caching strategy for token-wise conservative caching, which is compatible with flash attention and requires no training and calibration data. Our codes have been released in Github: \textbf{Code: \href{https://github.com/Shenyi-Z/DuCa}{\texttt{\textcolor{cyan}{https://github.com/Shenyi-Z/DuCa}}}}

Intelligent System for Automated Molecular Patent Infringement Assessment

Automated drug discovery offers significant potential for accelerating the development of novel therapeutics by substituting labor-intensive human workflows with machine-driven processes. However, a critical bottleneck persists in the inability of current automated frameworks to assess whether newly designed molecules infringe upon existing patents, posing significant legal and financial risks. We introduce PatentFinder, a novel tool-enhanced and multi-agent framework that accurately and comprehensively evaluates small molecules for patent infringement. It incorporates both heuristic and model-based tools tailored for decomposed subtasks, featuring: MarkushParser, which is capable of optical chemical structure recognition of molecular and Markush structures, and MarkushMatcher, which enhances large language models' ability to extract substituent groups from molecules accurately. On our benchmark dataset MolPatent-240, PatentFinder outperforms baseline approaches that rely solely on large language models, demonstrating a 13.8\% increase in F1-score and a 12\% rise in accuracy. Experimental results demonstrate that PatentFinder mitigates label bias to produce balanced predictions and autonomously generates detailed, interpretable patent infringement reports. This work not only addresses a pivotal challenge in automated drug discovery but also demonstrates the potential of decomposing complex scientific tasks into manageable subtasks for specialized, tool-augmented agents.

Learning Robust Anymodal Segmentor with Unimodal and Cross-modal Distillation

Simultaneously using multimodal inputs from multiple sensors to train segmentors is intuitively advantageous but practically challenging. A key challenge is unimodal bias, where multimodal segmentors over rely on certain modalities, causing performance drops when others are missing, common in real world applications. To this end, we develop the first framework for learning robust segmentor that can handle any combinations of visual modalities. Specifically, we first introduce a parallel multimodal learning strategy for learning a strong teacher. The cross-modal and unimodal distillation is then achieved in the multi scale representation space by transferring the feature level knowledge from multimodal to anymodal segmentors, aiming at addressing the unimodal bias and avoiding over-reliance on specific modalities. Moreover, a prediction level modality agnostic semantic distillation is proposed to achieve semantic knowledge transferring for segmentation. Extensive experiments on both synthetic and real-world multi-sensor benchmarks demonstrate that our method achieves superior performance.

SAVEn-Vid: Synergistic Audio-Visual Integration for Enhanced Understanding in Long Video Context

Endeavors have been made to explore Large Language Models for video analysis (Video-LLMs), particularly in understanding and interpreting long videos. However, existing Video-LLMs still face challenges in effectively integrating the rich and diverse audio-visual information inherent in long videos, which is crucial for comprehensive understanding. This raises the question: how can we leverage embedded audio-visual information to enhance long video understanding? Therefore, (i) we introduce SAVEn-Vid, the first-ever long audio-visual video dataset comprising over 58k audio-visual instructions. (ii) From the model perspective, we propose a time-aware Audio-Visual Large Language Model (AV-LLM), SAVEnVideo, fine-tuned on SAVEn-Vid. (iii) Besides, we present AVBench, a benchmark containing 2,500 QAs designed to evaluate models on enhanced audio-visual comprehension tasks within long video, challenging their ability to handle intricate audio-visual interactions. Experiments on AVBench reveal the limitations of current AV-LLMs. Experiments also demonstrate that SAVEnVideo outperforms the best Video-LLM by 3.61% on the zero-shot long video task (Video-MME) and surpasses the leading audio-visual LLM by 1.29% on the zero-shot audio-visual task (Music-AVQA). Consequently, at the 7B parameter scale, SAVEnVideo can achieve state-of-the-art performance. Our dataset and code will be released at https://ljungang.github.io/SAVEn-Vid/ upon acceptance.

ICT: Image-Object Cross-Level Trusted Intervention for Mitigating Object Hallucination in Large Vision-Language Models

Despite the recent breakthroughs achieved by Large Vision Language Models (LVLMs) in understanding and responding to complex visual-textual contexts, their inherent hallucination tendencies limit their practical application in real-world scenarios that demand high levels of precision. Existing methods typically either fine-tune the LVLMs using additional data, which incurs extra costs in manual annotation and computational resources or perform comparisons at the decoding stage, which may eliminate useful language priors for reasoning while introducing inference time overhead. Therefore, we propose ICT, a lightweight, training-free method that calculates an intervention direction to shift the model's focus towards different levels of visual information, enhancing its attention to high-level and fine-grained visual details. During the forward pass stage, the intervention is applied to the attention heads that encode the overall image information and the fine-grained object details, effectively mitigating the phenomenon of overly language priors, and thereby alleviating hallucinations. Extensive experiments demonstrate that ICT achieves strong performance with a small amount of data and generalizes well across different datasets and models. Our code will be public.

MolParser: End-to-end Visual Recognition of Molecule Structures in the Wild

In recent decades, chemistry publications and patents have increased rapidly. A significant portion of key information is embedded in molecular structure figures, complicating large-scale literature searches and limiting the application of large language models in fields such as biology, chemistry, and pharmaceuticals. The automatic extraction of precise chemical structures is of critical importance. However, the presence of numerous Markush structures in real-world documents, along with variations in molecular image quality, drawing styles, and noise, significantly limits the performance of existing optical chemical structure recognition (OCSR) methods. We present MolParser, a novel end-to-end OCSR method that efficiently and accurately recognizes chemical structures from real-world documents, including difficult Markush structure. We use a extended SMILES encoding rule to annotate our training dataset. Under this rule, we build MolParser-7M, the largest annotated molecular image dataset to our knowledge. While utilizing a large amount of synthetic data, we employed active learning methods to incorporate substantial in-the-wild data, specifically samples cropped from real patents and scientific literature, into the training process. We trained an end-to-end molecular image captioning model, MolParser, using a curriculum learning approach. MolParser significantly outperforms classical and learning-based methods across most scenarios, with potential for broader downstream applications. The dataset is publicly available.

Multi-Stage Vision Token Dropping: Towards Efficient Multimodal Large Language Model

The vision tokens in multimodal large language models usually exhibit significant spatial and temporal redundancy and take up most of the input tokens, which harms their inference efficiency. To solve this problem, some recent works were introduced to drop the unimportant tokens during inference where the importance of each token is decided only by the information in either the vision encoding stage or the prefilling stage. In this paper, we propose Multi-stage Token Dropping (MustDrop) to measure the importance of each token from the whole lifecycle, including the vision encoding stage, prefilling stage, and decoding stage. Concretely, in the visual encoding stage, MustDrop merges spatially adjacent tokens with high similarity, and establishes a key token set to retain the most vision-critical tokens, preventing them from being discarded in later stages. In the prefilling stage, MustDrop further compresses vision tokens by the guidance of text semantics, with a dual-attention filtering strategy. In the decoding stage, an output-aware cache policy is proposed to further reduce the size of the KV cache. By leveraging tailored strategies in the multi-stage process, MustDrop can more precisely recognize the important and redundant tokens, thus achieving an optimal balance between performance and efficiency. For instance, MustDrop reduces about 88.5\% FLOPs on LLaVA with a compression ratio of 92.2\% while maintaining comparable accuracy. Our codes are available at \url{https://github.com/liuting20/MustDrop}.

Deep Learning Accelerated Quantum Transport Simulations in Nanoelectronics: From Break Junctions to Field-Effect Transistors

Quantum transport calculations are essential for understanding and designing nanoelectronic devices, yet the trade-off between accuracy and computational efficiency has long limited their practical applications. We present a general framework that combines the deep learning tight-binding Hamiltonian (DeePTB) approach with the non-equilibrium Green's Function (NEGF) method, enabling efficient quantum transport calculations while maintaining first-principles accuracy. We demonstrate the capabilities of the DeePTB-NEGF framework through two representative applications: comprehensive simulation of break junction systems, where conductance histograms show good agreement with experimental measurements in both metallic contact and single-molecule junction cases; and simulation of carbon nanotube field effect transistors through self-consistent NEGF-Poisson calculations, capturing essential physics including the electrostatic potential and transfer characteristic curves under finite bias conditions. This framework bridges the gap between first-principles accuracy and computational efficiency, providing a powerful tool for high-throughput quantum transport simulations across different scales in nanoelectronics.