Chaowen Hu

Yiheng Zhu, Jialu Wu, Chaowen Hu et al.

Many crucial scientific problems involve designing novel molecules with desired properties, which can be formulated as a black-box optimization problem over the discrete chemical space. In practice, multiple conflicting objectives and costly evaluations (e.g., wet-lab experiments) make the diversity of candidates paramount. Computational methods have achieved initial success but still struggle with considering diversity in both objective and search space. To fill this gap, we propose a multi-objective Bayesian optimization (MOBO) algorithm leveraging the hypernetwork-based GFlowNets (HN-GFN) as an acquisition function optimizer, with the purpose of sampling a diverse batch of candidate molecular graphs from an approximate Pareto front. Using a single preference-conditioned hypernetwork, HN-GFN learns to explore various trade-offs between objectives. We further propose a hindsight-like off-policy strategy to share high-performing molecules among different preferences in order to speed up learning for HN-GFN. We empirically illustrate that HN-GFN has adequate capacity to generalize over preferences. Moreover, experiments in various real-world MOBO settings demonstrate that our framework predominantly outperforms existing methods in terms of candidate quality and sample efficiency. The code is available at https://github.com/violet-sto/HN-GFN.

Xiaoliang Fu, Jiaye Lin, Yangyi Fang et al.

Reinforcement Learning with Verifiable Rewards (RLVR) has catalyzed a leap in Large Language Model (LLM) reasoning, yet its optimization dynamics remain fragile. Standard algorithms like GRPO enforce stability via ``hard clipping'', which inadvertently stifles exploration by discarding gradients of tokens outside the trust region. While recent ``soft clipping'' methods attempt to recover these gradients, they suffer from a critical challenge: relying on log-probability gradient ($\nabla_θ\log π_θ$) yields divergent weights as probabilities vanish, destabilizing LLM training. We rethink this convention by establishing probability gradient ($\nabla_θπ_θ$) as the superior optimization primitive. Accordingly, we propose Decoupled Gradient Policy Optimization (DGPO), which employs a decoupled decay mechanism based on importance sampling ratios. By applying asymmetric, continuous decay to boundary tokens, DGPO resolves the conflict between stability and sustained exploration. Extensive experiments across DeepSeek-R1-Distill-Qwen series models (1.5B/7B/14B) demonstrate that DGPO consistently outperforms strong baselines on various mathematical benchmarks, offering a robust and scalable solution for RLVR. Our code and implementation are available at: https://github.com/VenomRose-Juri/DGPO-RL.

Xiaoliang Fu, Jiaye Lin, Yangyi Fang et al.

Existing Reinforcement Learning with Verifiable Rewards (RLVR) algorithms, such as GRPO, rely on rigid, uniform, and symmetric trust region mechanisms that are fundamentally misaligned with the complex optimization dynamics of Large Language Models (LLMs). In this paper, we identify three critical challenges in these methods: (1) inefficient gradient utilization caused by the binary cutoff of hard clipping, (2) insensitive probability mass arising from uniform ratio constraints that ignore the token distribution, and (3) asymmetric signal reliability stemming from the disparate credit assignment ambiguity between positive and negative samples. To bridge these gaps, we propose Mass-Adaptive Soft Policy Optimization (MASPO), a unified framework designed to harmonize these three dimensions. MASPO integrates a differentiable soft Gaussian gating to maximize gradient utility, a mass-adaptive limiter to balance exploration across the probability spectrum, and an asymmetric risk controller to align update magnitudes with signal confidence. Extensive evaluations demonstrate that MASPO serves as a robust, all-in-one RLVR solution, significantly outperforming strong baselines. Our code is available at: https://anonymous.4open.science/r/ma1/README.md.

Yangyi Fang, Jiaye Lin, Xiaoliang Fu et al.

Reinforcement Learning with Verifiable Rewards (RLVR) has proven effective for Large Language Model (LLM) reasoning, yet current methods face key challenges in resource allocation and policy optimization dynamics: (i) uniform rollout allocation ignores gradient variance heterogeneity across problems, and (ii) the softmax policy structure causes gradient attenuation for high-confidence correct actions, while excessive gradient updates may destabilize training. Therefore, we propose DynaMO, a theoretically-grounded dual-pronged optimization framework. At the sequence level, we prove that uniform allocation is suboptimal and derive variance-minimizing allocation from the first principle, establishing Bernoulli variance as a computable proxy for gradient informativeness. At the token level, we develop gradient-aware advantage modulation grounded in theoretical analysis of gradient magnitude bounds. Our framework compensates for gradient attenuation of high-confidence correct actions while utilizing entropy changes as computable indicators to stabilize excessive update magnitudes. Extensive experiments conducted on a diverse range of mathematical reasoning benchmarks demonstrate consistent improvements over strong RLVR baselines. Our implementation is available at: \href{https://anonymous.4open.science/r/dynamo-680E/README.md}{https://anonymous.4open.science/r/dynamo}.

Jiahuan Yan, Jintai Chen, Chaowen Hu et al.

Recent development in large language models (LLMs) has demonstrated impressive domain proficiency on unstructured textual or multi-modal tasks. However, despite with intrinsic world knowledge, their application on structured tabular data prediction still lags behind, primarily due to the numerical insensitivity and modality discrepancy that brings a gap between LLM reasoning and statistical tabular learning. Unlike textual or vision data (e.g., electronic clinical notes or medical imaging data), tabular data is often presented in heterogeneous numerical values (e.g., CBC reports). This ubiquitous data format requires intensive expert annotation, and its numerical nature limits LLMs' capability to effectively transfer untapped domain expertise. In this paper, we propose SERSAL, a general self-prompting method by synergy learning with small models to enhance LLM tabular prediction in an unsupervised manner. Specifically, SERSAL utilizes the LLM's prior outcomes as original soft noisy annotations, which are dynamically leveraged to teach a better small student model. Reversely, the outcomes from the trained small model are used to teach the LLM to further refine its real capability. This process can be repeatedly applied to gradually distill refined knowledge for continuous progress. Comprehensive experiments on widely used medical domain tabular datasets show that, without access to gold labels, applying SERSAL to OpenAI GPT reasoning process attains substantial improvement compared to linguistic prompting methods, which serves as an orthogonal direction for tabular LLM, and increasing prompting bonus is observed as more powerful LLMs appear.

Xuxin Cheng, Ke Zeng, Zhiquan Cao et al.

Enhancing customer experience is essential for business success, particularly as service demands grow in scale and complexity. Generative artificial intelligence and Large Language Models (LLMs) have empowered intelligent interaction systems to deliver efficient, personalized, and 24/7 support. In practice, intelligent interaction systems encounter several challenges: (1) Constructing high-quality data for cold-start training is difficult, hindering self-evolution and raising labor costs. (2) Multi-turn dialogue performance remains suboptimal due to inadequate intent understanding, rule compliance, and solution extraction. (3) Frequent evolution of business rules affects system operability and transferability, constraining low-cost expansion and adaptability. (4) Reliance on a single LLM is insufficient in complex scenarios, where the absence of multi-agent frameworks and effective collaboration undermines process completeness and service quality. (5) The open-domain nature of multi-turn dialogues, lacking unified golden answers, hampers quantitative evaluation and continuous optimization. To address these challenges, we introduce WOWService, an intelligent interaction system tailored for industrial applications. With the integration of LLMs and multi-agent architectures, WOWService enables autonomous task management and collaborative problem-solving. Specifically, WOWService focuses on core modules including data construction, general capability enhancement, business scenario adaptation, multi-agent coordination, and automated evaluation. Currently, WOWService is deployed on the Meituan App, achieving significant gains in key metrics, e.g., User Satisfaction Metric 1 (USM 1) -27.53% and User Satisfaction Metric 2 (USM 2) +25.51%, demonstrating its effectiveness in capturing user needs and advancing personalized service.