arXiv subjects

Yimi Wang

Publications and source records attributed to Yimi Wang.

5 recordsLinked to original sources

arXiv2026

Divergence Decoding: Training-Free Capability Fusion

While large language models excel in reasoning, these generalists often lack knowledge for specialized scientific domains. Conversely, domain models~(specialists), while knowledgeable, suffer from specialization side-effects including diminished logic and reduced robustness.To address this dilemma, we introduce Divergence Decoding, a training-free framework for capability fusion. It reconstructs the "draft-and-verify" skeleton of speculative decoding into an adaptive routing mechanism. The core is using Jensen-Shannon divergence to monitor the distributional disagreement between the two models at each token. When the specialist exhibits significant divergence, our method identifies it as a potential reasoning risk and instantaneously routes control to the generalist. This allows the dynamic injection of general reasoning while preserving domain expertise, achieving inference-time policy composition of the generalist and the specialist.We evaluate Divergence Decoding across diverse model families (Qwen and Llama series) on challenging scientific benchmarks (GPQA, ChemBench, and ChemCoTBench). Experimental results demonstrate that Divergence Decoding outperforms both the domain-specialized and general-purpose models, effectively surpassing the performance of most single-model baseline. This suggests that Divergence Decoding provides a general, training-free paradigm for fusing diverse LLM capabilities through adaptive inference-time collaboration.

cs.AI↗

arXiv2026

MoleCode unlocks structural intelligence in large language models

Molecules are graphs, but large language models~(LLMs) are usually asked to reason about them through linear strings. The most popular molecular representation, SMILES, compresses atoms, bonds, branches and rings into a compact sequence in which topology is implicit, forcing LLMs to reconstruct molecular structure before performing the requested chemical operation. Here we introduce MoleCode, an LLM-native, training-free, graph-explicit molecular language in which all molecular components are represented as typed entities with persistent identifiers and explicit relations. MoleCode makes molecular topology directly readable, editable and auditable within the language context, allowing an LLM to operate on structure rather than recover it from syntax. Across molecular reasoning, editing, generation and analysis tasks, this representational shift improves frontier LLMs most strongly when structural access is limiting: unfamiliar molecules, topology-sensitive operations, larger structures and repetitive polymers. It also changes how inference is allocated, replacing long reasoning traces devoted to implicit structural reconstruction with shorter, more chemically directed reasoning over explicit atoms and bonds. In molecular optimization, this enables localized, property-aligned edits that preserve structural similarity to the starting compounds. The same Subgraph--Node--Edge grammar extends beyond small molecules to polymers, Markush structures, mechanism-style transformations and interleaved scientific documents, including research articles and patent disclosures in which chemical information is distributed across text and images. These results suggest that the interface between scientific objects and LLMs should not treat structure as something to be decoded from text. When the object of reasoning is relational, the structure itself should be part of the language.

q-bio.BM↗

arXiv2024

DecomCAM: Advancing Beyond Saliency Maps through Decomposition and Integration

Interpreting complex deep networks, notably pre-trained vision-language models (VLMs), is a formidable challenge. Current Class Activation Map (CAM) methods highlight regions revealing the model's decision-making basis but lack clear saliency maps and detailed interpretability. To bridge this gap, we propose DecomCAM, a novel decomposition-and-integration method that distills shared patterns from channel activation maps. Utilizing singular value decomposition, DecomCAM decomposes class-discriminative activation maps into orthogonal sub-saliency maps (OSSMs), which are then integrated together based on their contribution to the target concept. Extensive experiments on six benchmarks reveal that DecomCAM not only excels in locating accuracy but also achieves an optimizing balance between interpretability and computational efficiency. Further analysis unveils that OSSMs correlate with discernible object components, facilitating a granular understanding of the model's reasoning. This positions DecomCAM as a potential tool for fine-grained interpretation of advanced deep learning models. The code is avaible at https://github.com/CapricornGuang/DecomCAM.

cs.CV↗

arXiv2023

Self-Enhancement Improves Text-Image Retrieval in Foundation Visual-Language Models

The emergence of cross-modal foundation models has introduced numerous approaches grounded in text-image retrieval. However, on some domain-specific retrieval tasks, these models fail to focus on the key attributes required. To address this issue, we propose a self-enhancement framework, A^{3}R, based on the CLIP-ViT/G-14, one of the largest cross-modal models. First, we perform an Attribute Augmentation strategy to enrich the textual description for fine-grained representation before model learning. Then, we propose an Adaption Re-ranking method to unify the representation space of textual query and candidate images and re-rank candidate images relying on the adapted query after model learning. The proposed framework is validated to achieve a salient improvement over the baseline and other teams' solutions in the cross-modal image retrieval track of the 1st foundation model challenge without introducing any additional samples. The code is available at \url{https://github.com/CapricornGuang/A3R}.

cs.CV↗

arXiv2023

Decom--CAM: Tell Me What You See, In Details! Feature-Level Interpretation via Decomposition Class Activation Map

Interpretation of deep learning remains a very challenging problem. Although the Class Activation Map (CAM) is widely used to interpret deep model predictions by highlighting object location, it fails to provide insight into the salient features used by the model to make decisions. Furthermore, existing evaluation protocols often overlook the correlation between interpretability performance and the model's decision quality, which presents a more fundamental issue. This paper proposes a new two-stage interpretability method called the Decomposition Class Activation Map (Decom-CAM), which offers a feature-level interpretation of the model's prediction. Decom-CAM decomposes intermediate activation maps into orthogonal features using singular value decomposition and generates saliency maps by integrating them. The orthogonality of features enables CAM to capture local features and can be used to pinpoint semantic components such as eyes, noses, and faces in the input image, making it more beneficial for deep model interpretation. To ensure a comprehensive comparison, we introduce a new evaluation protocol by dividing the dataset into subsets based on classification accuracy results and evaluating the interpretability performance on each subset separately. Our experiments demonstrate that the proposed Decom-CAM outperforms current state-of-the-art methods significantly by generating more precise saliency maps across all levels of classification accuracy. Combined with our feature-level interpretability approach, this paper could pave the way for a new direction for understanding the decision-making process of deep neural networks.

cs.CV↗