Kui Huang

Yizhen Luo, Xing Yi Liu, Kai Yang et al.

In recent years, AI models that mine intrinsic patterns from molecular structures and protein sequences have shown promise in accelerating drug discovery. However, these methods partly lag behind real-world pharmaceutical approaches of human experts that additionally grasp structured knowledge from knowledge bases and unstructured knowledge from biomedical literature. To bridge this gap, we propose KEDD, a unified, end-to-end, and multimodal deep learning framework that optimally incorporates both structured and unstructured knowledge for vast AI drug discovery tasks. The framework first extracts underlying characteristics from heterogeneous inputs, and then applies multimodal fusion for accurate prediction. To mitigate the problem of missing modalities, we leverage multi-head sparse attention and a modality masking mechanism to extract relevant information robustly. Benefiting from integrated knowledge, our framework achieves a deeper understanding of molecule entities, brings significant improvements over state-of-the-art methods on a wide range of tasks and benchmarks, and reveals its promising potential in assisting real-world drug discovery.

Xu Chu, Xinrong Chen, Guanyu Wang et al.

Inference time scaling drives extended reasoning to enhance the performance of Vision-Language Models (VLMs), thus forming powerful Vision-Language Reasoning Models (VLRMs). However, long reasoning dilutes visual tokens, causing visual information to receive less attention and may trigger hallucinations. Although introducing text-only reflection processes shows promise in language models, we demonstrate that it is insufficient to suppress hallucinations in VLMs. To address this issue, we introduce Qwen-LookAgain (Qwen-LA), a novel VLRM designed to mitigate hallucinations by incorporating a vision-text reflection process that guides the model to re-attention visual information during reasoning. We first propose a reinforcement learning method Balanced Reflective Policy Optimization (BRPO), which guides the model to decide when to generate vision-text reflection on its own and balance the number and length of reflections. Then, we formally prove that VLRMs lose attention to visual tokens as reasoning progresses, and demonstrate that supplementing visual information during reflection enhances visual attention. Therefore, during training and inference, Visual Token COPY and Visual Token ROUTE are introduced to force the model to re-attention visual information at the visual level, addressing the limitations of text-only reflection. Experiments on multiple visual QA datasets and hallucination metrics indicate that Qwen-LA achieves leading accuracy performance while reducing hallucinations. Our code is available at: https://github.com/Liar406/Look_Again

Kui Huang, Mengke Song, Shuo Ba et al.

Waste classification is crucial for improving processing efficiency and reducing environmental pollution. Supervised deep learning methods are commonly used for automated waste classification, but they rely heavily on large labeled datasets, which are costly and inefficient to obtain. Real-world waste data often exhibit category and style biases, such as variations in camera angles, lighting conditions, and types of waste, which can impact the model's performance and generalization ability. Therefore, constructing a bias-free dataset is essential. Manual labeling is not only costly but also inefficient. While self-supervised learning helps address data scarcity, it still depends on some labeled data and generally results in lower accuracy compared to supervised methods. Unsupervised methods show potential in certain cases but typically do not perform as well as supervised models, highlighting the need for an efficient and cost-effective unsupervised approach. This study presents a novel unsupervised method, Dual-Encoder Contrastive Learning with Multi-Clustering Voting (DECMCV). The approach involves using a pre-trained ConvNeXt model for image encoding, leveraging VisionTransformer to generate positive samples, and applying a multi-clustering voting mechanism to address data labeling and domain shift issues. Experimental results demonstrate that DECMCV achieves classification accuracies of 93.78% and 98.29% on the TrashNet and Huawei Cloud datasets, respectively, outperforming or matching supervised models. On a real-world dataset of 4,169 waste images, only 50 labeled samples were needed to accurately label thousands, improving classification accuracy by 29.85% compared to supervised models. This method effectively addresses style differences, enhances model generalization, and contributes to the advancement of automated waste classification.