Abstract:Molecular property prediction aims to learn representations that map chemical structures to functional properties. While multimodal learning has emerged as a powerful paradigm to learn molecular representations, prior works have largely overlooked textual and taxonomic information of molecules for representation learning. We introduce TRIDENT, a novel framework that integrates molecular SMILES, textual descriptions, and taxonomic functional annotations to learn rich molecular representations. To achieve this, we curate a comprehensive dataset of molecule-text pairs with structured, multi-level functional annotations. Instead of relying on conventional contrastive loss, TRIDENT employs a volume-based alignment objective to jointly align tri-modal features at the global level, enabling soft, geometry-aware alignment across modalities. Additionally, TRIDENT introduces a novel local alignment objective that captures detailed relationships between molecular substructures and their corresponding sub-textual descriptions. A momentum-based mechanism dynamically balances global and local alignment, enabling the model to learn both broad functional semantics and fine-grained structure-function mappings. TRIDENT achieves state-of-the-art performance on 11 downstream tasks, demonstrating the value of combining SMILES, textual, and taxonomic functional annotations for molecular property prediction.
Abstract:Recommender systems have been widely used in various large-scale user-oriented platforms for many years. However, compared to the rapid developments in the AI community, recommendation systems have not achieved a breakthrough in recent years. For instance, they still rely on a multi-stage cascaded architecture rather than an end-to-end approach, leading to computational fragmentation and optimization inconsistencies, and hindering the effective application of key breakthrough technologies from the AI community in recommendation scenarios. To address these issues, we propose OneRec, which reshapes the recommendation system through an end-to-end generative approach and achieves promising results. Firstly, we have enhanced the computational FLOPs of the current recommendation model by 10 $\times$ and have identified the scaling laws for recommendations within certain boundaries. Secondly, reinforcement learning techniques, previously difficult to apply for optimizing recommendations, show significant potential in this framework. Lastly, through infrastructure optimizations, we have achieved 23.7% and 28.8% Model FLOPs Utilization (MFU) on flagship GPUs during training and inference, respectively, aligning closely with the LLM community. This architecture significantly reduces communication and storage overhead, resulting in operating expense that is only 10.6% of traditional recommendation pipelines. Deployed in Kuaishou/Kuaishou Lite APP, it handles 25% of total queries per second, enhancing overall App Stay Time by 0.54% and 1.24%, respectively. Additionally, we have observed significant increases in metrics such as 7-day Lifetime, which is a crucial indicator of recommendation experience. We also provide practical lessons and insights derived from developing, optimizing, and maintaining a production-scale recommendation system with significant real-world impact.
Abstract:With the development of Embodied Artificial intelligence, the end-to-end control policy such as Vision-Language-Action (VLA) model has become the mainstream. Existing VLA models faces expensive computing/storage cost, which need to be optimized. Quantization is considered as the most effective method which can not only reduce the memory cost but also achieve computation acceleration. However, we find the token alignment of VLA models hinders the application of existing quantization methods. To address this, we proposed an optimized framework called EaqVLA, which apply encoding-aligned quantization to VLA models. Specifically, we propose an complete analysis method to find the misalignment in various granularity. Based on the analysis results, we propose a mixed precision quantization with the awareness of encoding alignment. Experiments shows that the porposed EaqVLA achieves better quantization performance (with the minimal quantization loss for end-to-end action control and xxx times acceleration) than existing quantization methods.
Abstract:Scoliosis is a spinal curvature disorder that is difficult to detect early and can compress the chest cavity, impacting respiratory function and cardiac health. Especially for adolescents, delayed detection and treatment result in worsening compression. Traditional scoliosis detection methods heavily rely on clinical expertise, and X-ray imaging poses radiation risks, limiting large-scale early screening. We propose an Attention-Guided Deep Multi-Instance Learning method (Gait-MIL) to effectively capture discriminative features from gait patterns, which is inspired by ScoNet-MT's pioneering use of gait patterns for scoliosis detection. We evaluate our method on the first large-scale dataset based on gait patterns for scoliosis classification. The results demonstrate that our study improves the performance of using gait as a biomarker for scoliosis detection, significantly enhances detection accuracy for the particularly challenging Neutral cases, where subtle indicators are often overlooked. Our Gait-MIL also performs robustly in imbalanced scenarios, making it a promising tool for large-scale scoliosis screening.
Abstract:Referring expression comprehension (REC) aims at achieving object localization based on natural language descriptions. However, existing REC approaches are constrained by object category descriptions and single-attribute intention descriptions, hindering their application in real-world scenarios. In natural human-robot interactions, users often express their desires through individual states and intentions, accompanied by guiding gestures, rather than detailed object descriptions. To address this challenge, we propose Multi-ref EC, a novel task framework that integrates state descriptions, derived intentions, and embodied gestures to locate target objects. We introduce the State-Intention-Gesture Attributes Reference (SIGAR) dataset, which combines state and intention expressions with embodied references. Through extensive experiments with various baseline models on SIGAR, we demonstrate that properly ordered multi-attribute references contribute to improved localization performance, revealing that single-attribute reference is insufficient for natural human-robot interaction scenarios. Our findings underscore the importance of multi-attribute reference expressions in advancing visual-language understanding.
Abstract:The rapid development of large language models (LLMs) has brought significant attention to speech models, particularly recent progress in speech2speech protocols supporting speech input and output. However, the existing benchmarks adopt automatic text-based evaluators for evaluating the instruction following ability of these models lack consideration for paralinguistic information in both speech understanding and generation. To address these issues, we introduce S2S-Arena, a novel arena-style S2S benchmark that evaluates instruction-following capabilities with paralinguistic information in both speech-in and speech-out across real-world tasks. We design 154 samples that fused TTS and live recordings in four domains with 21 tasks and manually evaluate existing popular speech models in an arena-style manner. The experimental results show that: (1) in addition to the superior performance of GPT-4o, the speech model of cascaded ASR, LLM, and TTS outperforms the jointly trained model after text-speech alignment in speech2speech protocols; (2) considering paralinguistic information, the knowledgeability of the speech model mainly depends on the LLM backbone, and the multilingual support of that is limited by the speech module; (3) excellent speech models can already understand the paralinguistic information in speech input, but generating appropriate audio with paralinguistic information is still a challenge.
Abstract:User simulators are crucial for replicating human interactions with dialogue systems, supporting both collaborative training and automatic evaluation, especially for large language models (LLMs). However, existing simulators often rely solely on text utterances, missing implicit user traits such as personality, speaking style, and goals. In contrast, persona-based methods lack generalizability, as they depend on predefined profiles of famous individuals or archetypes. To address these challenges, we propose User Simulator with implicit Profiles (USP), a framework that infers implicit user profiles from human-machine conversations and uses them to generate more personalized and realistic dialogues. We first develop an LLM-driven extractor with a comprehensive profile schema. Then, we refine the simulation through conditional supervised fine-tuning and reinforcement learning with cycle consistency, optimizing it at both the utterance and conversation levels. Finally, we adopt a diverse profile sampler to capture the distribution of real-world user profiles. Experimental results demonstrate that USP outperforms strong baselines in terms of authenticity and diversity while achieving comparable performance in consistency. Furthermore, dynamic multi-turn evaluations based on USP strongly align with mainstream benchmarks, demonstrating its effectiveness in real-world applications.
Abstract:Traditional sequential recommendation (SR) methods heavily rely on explicit item IDs to capture user preferences over time. This reliance introduces critical limitations in cold-start scenarios and domain transfer tasks, where unseen items and new contexts often lack established ID mappings. To overcome these limitations, recent studies have shifted towards leveraging text-only information for recommendation, thereby improving model generalization and adaptability across domains. Although promising, text-based SR faces unique difficulties: items' text descriptions often share semantic similarities that lead to clustered item representations, compromising their uniformity, a property essential for promoting diversity and enhancing generalization in recommendation systems. In this paper, we explore a novel framework to improve the uniformity of item representations in text-based SR. Our analysis reveals that items within a sequence exhibit marked semantic similarity, meaning they are closer in representation than items overall, and that this effect is more pronounced for less popular items, which form tighter clusters compared to their more popular counterparts. Based on these findings, we propose UniT, a framework that employs three pairwise item sampling strategies: Unified General Sampling Strategy, Sequence-Driven Sampling Strategy, and Popularity-Driven Sampling Strategy. Each strategy applies varying degrees of repulsion to selectively adjust the distances between item pairs, thereby refining representation uniformity while considering both sequence context and item popularity. Extensive experiments on multiple real-world datasets demonstrate that our proposed approach outperforms state-of-the-art models, validating the effectiveness of UniT in enhancing both representation uniformity and recommendation accuracy.The source code is available at https://github.com/ccwwhhh/Model-Rec.
Abstract:Direct Preference Optimization (DPO) and its variants have become increasingly popular for aligning language models with human preferences. These methods aim to teach models to better distinguish between chosen (or preferred) and rejected (or dispreferred) responses. However, prior research has identified that the probability of chosen responses often decreases during training, and this phenomenon is known as likelihood displacement. To tackle this challenge, in this work we introduce \method to controllably shift the distribution of the chosen probability. Then, we show that \method exhibits a fundamental trade-off between improving the chosen probability and sacrificing the reward margin, as supported by both theoretical analysis and experimental validation. Furthermore, we demonstrate the superiority of \method over DPO on downstream tasks such as MT-Bench and a designed win rate experiment. We believe this study shows that the likelihood displacement issue of DPO can be effectively mitigated with a simple, theoretically grounded solution. Our code is available at https://github.com/Meaquadddd/DPO-Shift.
Abstract:CLIP (Contrastive Language-Image Pre-training) has attained great success in pattern recognition and computer vision. Transferring CLIP to downstream tasks (e.g. zero- or few-shot classification) is a hot topic in multimodal learning. However, current studies primarily focus on either prompt learning for text or adapter tuning for vision, without fully exploiting the complementary information and correlations among image-text pairs. In this paper, we propose an Image Description Enhanced CLIP-Adapter (IDEA) method to adapt CLIP to few-shot image classification tasks. This method captures fine-grained features by leveraging both visual features and textual descriptions of images. IDEA is a training-free method for CLIP, and it can be comparable to or even exceeds state-of-the-art models on multiple tasks. Furthermore, we introduce Trainable-IDEA (T-IDEA), which extends IDEA by adding two lightweight learnable components (i.e., a projector and a learnable latent space), further enhancing the model's performance and achieving SOTA results on 11 datasets. As one important contribution, we employ the Llama model and design a comprehensive pipeline to generate textual descriptions for images of 11 datasets, resulting in a total of 1,637,795 image-text pairs, named "IMD-11". Our code and data are released at https://github.com/FourierAI/IDEA.