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Designing de novo 3D molecules with desirable properties remains a fundamental challenge in drug discovery and molecular engineering. While diffusion models have demonstrated remarkable capabilities in generating high-quality 3D molecular…

Machine Learning · Computer Science 2026-01-15 Lianghong Chen , Dongkyu Eugene Kim , Mike Domaratzki , Pingzhao Hu

We address the problem of fine-tuning pre-trained generative policies with reinforcement learning (RL) while preserving the multimodality of their action distributions. Existing methods for RL fine-tuning of generative policies (e.g.,…

Machine Learning · Computer Science 2026-05-13 Alberta Longhini , David Emukpere , Jean-Michel Renders , Seungsu Kim

Diffusion models achieve state-of-the-art generative performance but are fundamentally bottlenecked by their slow, iterative sampling process. While diffusion distillation techniques enable high-fidelity, few-step generation, traditional…

Computer Vision and Pattern Recognition · Computer Science 2026-04-01 Linqian Fan , Peiqin Sun , Tiancheng Wen , Shun Lu , Chengru Song

This study investigates the effectiveness of reinforcement learning (RL) fine-tuning techniques on a compact language model (Qwen2.5-0.5B Base) for two challenging tasks: instruction following and mathematical reasoning. We compare…

Computation and Language · Computer Science 2025-07-29 Yifu Han , Geo Zhang

While large-scale unsupervised language models (LMs) learn broad world knowledge and some reasoning skills, achieving precise control of their behavior is difficult due to the completely unsupervised nature of their training. Existing…

Machine Learning · Computer Science 2024-07-31 Rafael Rafailov , Archit Sharma , Eric Mitchell , Stefano Ermon , Christopher D. Manning , Chelsea Finn

Test-time scaling through reward-guided generation remains largely unexplored for discrete diffusion models despite its potential as a promising alternative. In this work, we introduce Iterative Reward-Guided Refinement (IterRef), a novel…

Machine Learning · Computer Science 2025-11-11 Sanghyun Lee , Sunwoo Kim , Seungryong Kim , Jongho Park , Dongmin Park

Offline reinforcement learning (RL) methods harness previous experiences to derive an optimal policy, forming the foundation for pre-trained large-scale models (PLMs). When encountering tasks not seen before, PLMs often utilize several…

Machine Learning · Computer Science 2024-11-05 Shengchao Hu , Wanru Zhao , Weixiong Lin , Li Shen , Ya Zhang , Dacheng Tao

Reinforcement learning has become a central paradigm for improving LLM reasoning, but most existing methods optimize policies over discrete token sequences. This creates a mismatch between the optimization space and the structure of…

Machine Learning · Computer Science 2026-05-19 Haoqiang Kang , Yizhe Zhang , Nikki Lijing Kuang , Yi-An Ma , Lianhui Qin

Model-based reinforcement learning (MBRL) has gained much attention for its ability to learn complex behaviors in a sample-efficient way: planning actions by generating imaginary trajectories with predicted rewards. Despite its success, we…

Machine Learning · Computer Science 2024-02-20 Vint Lee , Pieter Abbeel , Youngwoon Lee

Diffusion large language models (dLLMs) are promising alternatives to autoregressive large language models (AR-LLMs), as they potentially allow higher inference throughput. Reinforcement learning (RL) is a crucial component for dLLMs to…

Machine Learning · Computer Science 2026-02-24 Yuchen Zhu , Wei Guo , Jaemoo Choi , Petr Molodyk , Bo Yuan , Molei Tao , Yongxin Chen

Traditional preference tuning methods for LLMs/Visual Generative Models often rely solely on reward model labeling, which can be opaque, offer limited insights into the rationale behind preferences, and are prone to issues such as reward…

Machine Learning · Computer Science 2026-01-13 Hanyang Zhao , Haoxian Chen , Yucheng Guo , Genta Indra Winata , Tingting Ou , Ziyu Huang , David D. Yao , Wenpin Tang

Diffusion models have achieved state-of-the-art performance across multiple domains, with recent advancements extending their applicability to discrete data. However, aligning discrete diffusion models with task-specific preferences remains…

Machine Learning · Computer Science 2025-04-10 Umberto Borso , Davide Paglieri , Jude Wells , Tim Rocktäschel

Inference scaling further accelerates Large Language Models (LLMs) toward Artificial General Intelligence (AGI), with large-scale Reinforcement Learning (RL) to unleash long Chain-of-Thought reasoning. Most contemporary reasoning approaches…

Machine Learning · Computer Science 2025-05-20 Xuerui Su , Liya Guo , Yue Wang , Yi Zhu , Zhiming Ma , Zun Wang , Yuting Liu

Diffusion-based image super-resolution (SR) methods have achieved remarkable success by leveraging large pre-trained text-to-image diffusion models as priors. However, these methods still face two challenges: the requirement for dozens of…

Computer Vision and Pattern Recognition · Computer Science 2024-09-26 Aiping Zhang , Zongsheng Yue , Renjing Pei , Wenqi Ren , Xiaochun Cao

This tutorial provides an in-depth guide on inference-time guidance and alignment methods for optimizing downstream reward functions in diffusion models. While diffusion models are renowned for their generative modeling capabilities,…

Artificial Intelligence · Computer Science 2025-01-22 Masatoshi Uehara , Yulai Zhao , Chenyu Wang , Xiner Li , Aviv Regev , Sergey Levine , Tommaso Biancalani

Although diffusion models have achieved strong results in decision-making tasks, their slow inference speed remains a key limitation. While consistency models offer a potential solution, existing applications to decision-making either…

Machine Learning · Computer Science 2026-02-09 Xintong Duan , Yutong He , Fahim Tajwar , Ruslan Salakhutdinov , J. Zico Kolter , Jeff Schneider

Diffusion models have become a central paradigm for image and multimodal generation, yet their deployment raises persistent questions about alignment, safety, preference satisfaction, and robustness to misuse. This survey reviews recent…

Computer Vision and Pattern Recognition · Computer Science 2026-05-19 Preeti Lamba , Kiran Ravish , Ankita Kushwaha , Pawan Kumar

Large Reasoning Models (LRMs) have shown remarkable capabilities in solving complex problems through reinforcement learning (RL), particularly by generating long reasoning traces. However, these extended outputs often exhibit substantial…

Computation and Language · Computer Science 2025-05-22 Wei Liu , Ruochen Zhou , Yiyun Deng , Yuzhen Huang , Junteng Liu , Yuntian Deng , Yizhe Zhang , Junxian He

Efficient and effective learning is one of the ultimate goals of the deep reinforcement learning (DRL), although the compromise has been made in most of the time, especially for the application of robot manipulations. Learning is always…

Machine Learning · Computer Science 2020-03-06 Yongle Luo , Kun Dong , Lili Zhao , Zhiyong Sun , Chao Zhou , Bo Song

In recent years, motion generative models have undergone significant advancement, yet pose challenges in aligning with downstream objectives. Recent studies have shown that using differentiable rewards to directly align the preference of…

Computer Vision and Pattern Recognition · Computer Science 2026-02-10 Xiaofeng Tan , Wanjiang Weng , Haodong Lei , Hongsong Wang
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