Tang, Jian
Landscape of Thoughts: Visualizing the Reasoning Process of Large Language Models
Zhou, Zhanke, Zhu, Zhaocheng, Li, Xuan, Galkin, Mikhail, Feng, Xiao, Koyejo, Sanmi, Tang, Jian, Han, Bo
Numerous applications of large language models (LLMs) rely on their ability to perform step-by-step reasoning. However, the reasoning behavior of LLMs remains poorly understood, posing challenges to research, development, and safety. To address this gap, we introduce landscape of thoughts-the first visualization tool for users to inspect the reasoning paths of chain-of-thought and its derivatives on any multi-choice dataset. Specifically, we represent the states in a reasoning path as feature vectors that quantify their distances to all answer choices. These features are then visualized in two-dimensional plots using t-SNE. Qualitative and quantitative analysis with the landscape of thoughts effectively distinguishes between strong and weak models, correct and incorrect answers, as well as different reasoning tasks. It also uncovers undesirable reasoning patterns, such as low consistency and high uncertainty. Additionally, users can adapt our tool to a model that predicts the property they observe. We showcase this advantage by adapting our tool to a lightweight verifier that evaluates the correctness of reasoning paths. The code is publicly available at: https://github.com/tmlr-group/landscape-of-thoughts.
EmbodiedVSR: Dynamic Scene Graph-Guided Chain-of-Thought Reasoning for Visual Spatial Tasks
Zhang, Yi, Zhang, Qiang, Ju, Xiaozhu, Liu, Zhaoyang, Mao, Jilei, Sun, Jingkai, Wu, Jintao, Gao, Shixiong, Cai, Shihan, Qin, Zhiyuan, Liang, Linkai, Wang, Jiaxu, Duan, Yiqun, Cao, Jiahang, Xu, Renjing, Tang, Jian
While multimodal large language models (MLLMs) have made groundbreaking progress in embodied intelligence, they still face significant challenges in spatial reasoning for complex long-horizon tasks. To address this gap, we propose EmbodiedVSR (Embodied Visual Spatial Reasoning), a novel framework that integrates dynamic scene graph-guided Chain-of-Thought (CoT) reasoning to enhance spatial understanding for embodied agents. By explicitly constructing structured knowledge representations through dynamic scene graphs, our method enables zero-shot spatial reasoning without task-specific fine-tuning. This approach not only disentangles intricate spatial relationships but also aligns reasoning steps with actionable environmental dynamics. To rigorously evaluate performance, we introduce the eSpatial-Benchmark, a comprehensive dataset including real-world embodied scenarios with fine-grained spatial annotations and adaptive task difficulty levels. Experiments demonstrate that our framework significantly outperforms existing MLLM-based methods in accuracy and reasoning coherence, particularly in long-horizon tasks requiring iterative environment interaction. The results reveal the untapped potential of MLLMs for embodied intelligence when equipped with structured, explainable reasoning mechanisms, paving the way for more reliable deployment in real-world spatial applications. The codes and datasets will be released soon.
HumanoidPano: Hybrid Spherical Panoramic-LiDAR Cross-Modal Perception for Humanoid Robots
Zhang, Qiang, Zhang, Zhang, Cui, Wei, Sun, Jingkai, Cao, Jiahang, Guo, Yijie, Han, Gang, Zhao, Wen, Wang, Jiaxu, Sun, Chenghao, Zhang, Lingfeng, Cheng, Hao, Chen, Yujie, Wang, Lin, Tang, Jian, Xu, Renjing
The perceptual system design for humanoid robots poses unique challenges due to inherent structural constraints that cause severe self-occlusion and limited field-of-view (FOV). We present HumanoidPano, a novel hybrid cross-modal perception framework that synergistically integrates panoramic vision and LiDAR sensing to overcome these limitations. Unlike conventional robot perception systems that rely on monocular cameras or standard multi-sensor configurations, our method establishes geometrically-aware modality alignment through a spherical vision transformer, enabling seamless fusion of 360 visual context with LiDAR's precise depth measurements. First, Spherical Geometry-aware Constraints (SGC) leverage panoramic camera ray properties to guide distortion-regularized sampling offsets for geometric alignment. Second, Spatial Deformable Attention (SDA) aggregates hierarchical 3D features via spherical offsets, enabling efficient 360{\deg}-to-BEV fusion with geometrically complete object representations. Third, Panoramic Augmentation (AUG) combines cross-view transformations and semantic alignment to enhance BEV-panoramic feature consistency during data augmentation. Extensive evaluations demonstrate state-of-the-art performance on the 360BEV-Matterport benchmark. Real-world deployment on humanoid platforms validates the system's capability to generate accurate BEV segmentation maps through panoramic-LiDAR co-perception, directly enabling downstream navigation tasks in complex environments. Our work establishes a new paradigm for embodied perception in humanoid robotics.
ACL-QL: Adaptive Conservative Level in Q-Learning for Offline Reinforcement Learning
Wu, Kun, Zhao, Yinuo, Xu, Zhiyuan, Che, Zhengping, Yin, Chengxiang, Liu, Chi Harold, Qiu, Qinru, Feng, Feiferi, Tang, Jian
Offline Reinforcement Learning (RL), which operates solely on static datasets without further interactions with the environment, provides an appealing alternative to learning a safe and promising control policy. The prevailing methods typically learn a conservative policy to mitigate the problem of Q-value overestimation, but it is prone to overdo it, leading to an overly conservative policy. Moreover, they optimize all samples equally with fixed constraints, lacking the nuanced ability to control conservative levels in a fine-grained manner. Consequently, this limitation results in a performance decline. To address the above two challenges in a united way, we propose a framework, Adaptive Conservative Level in Q-Learning (ACL-QL), which limits the Q-values in a mild range and enables adaptive control on the conservative level over each state-action pair, i.e., lifting the Q-values more for good transitions and less for bad transitions. We theoretically analyze the conditions under which the conservative level of the learned Q-function can be limited in a mild range and how to optimize each transition adaptively. Motivated by the theoretical analysis, we propose a novel algorithm, ACL-QL, which uses two learnable adaptive weight functions to control the conservative level over each transition. Subsequently, we design a monotonicity loss and surrogate losses to train the adaptive weight functions, Q-function, and policy network alternatively. We evaluate ACL-QL on the commonly used D4RL benchmark and conduct extensive ablation studies to illustrate the effectiveness and state-of-the-art performance compared to existing offline DRL baselines.
RoboMIND: Benchmark on Multi-embodiment Intelligence Normative Data for Robot Manipulation
Wu, Kun, Hou, Chengkai, Liu, Jiaming, Che, Zhengping, Ju, Xiaozhu, Yang, Zhuqin, Li, Meng, Zhao, Yinuo, Xu, Zhiyuan, Yang, Guang, Zhao, Zhen, Li, Guangyu, Jin, Zhao, Wang, Lecheng, Mao, Jilei, Wang, Xinhua, Fan, Shichao, Liu, Ning, Ren, Pei, Zhang, Qiang, Lyu, Yaoxu, Liu, Mengzhen, He, Jingyang, Luo, Yulin, Gao, Zeyu, Li, Chenxuan, Gu, Chenyang, Fu, Yankai, Wu, Di, Wang, Xingyu, Chen, Sixiang, Wang, Zhenyu, An, Pengju, Qian, Siyuan, Zhang, Shanghang, Tang, Jian
Developing robust and general-purpose robotic manipulation policies is a key goal in the field of robotics. To achieve effective generalization, it is essential to construct comprehensive datasets that encompass a large number of demonstration trajectories and diverse tasks. Unlike vision or language data that can be collected from the Internet, robotic datasets require detailed observations and manipulation actions, necessitating significant investment in hardware-software infrastructure and human labor. While existing works have focused on assembling various individual robot datasets, there remains a lack of a unified data collection standard and insufficient diversity in tasks, scenarios, and robot types. In this paper, we introduce RoboMIND (Multi-embodiment Intelligence Normative Data for Robot manipulation), featuring 55k real-world demonstration trajectories across 279 diverse tasks involving 61 different object classes. RoboMIND is collected through human teleoperation and encompasses comprehensive robotic-related information, including multi-view RGB-D images, proprioceptive robot state information, end effector details, and linguistic task descriptions. To ensure dataset consistency and reliability during policy learning, RoboMIND is built on a unified data collection platform and standardized protocol, covering four distinct robotic embodiments. We provide a thorough quantitative and qualitative analysis of RoboMIND across multiple dimensions, offering detailed insights into the diversity of our datasets. In our experiments, we conduct extensive real-world testing with four state-of-the-art imitation learning methods, demonstrating that training with RoboMIND data results in a high manipulation success rate and strong generalization. Our project is at https://x-humanoid-robomind.github.io/.
Multi-Scale Representation Learning for Protein Fitness Prediction
Zhang, Zuobai, Notin, Pascal, Huang, Yining, Lozano, Aurรฉlie, Chenthamarakshan, Vijil, Marks, Debora, Das, Payel, Tang, Jian
Designing novel functional proteins crucially depends on accurately modeling their fitness landscape. Given the limited availability of functional annotations from wet-lab experiments, previous methods have primarily relied on self-supervised models trained on vast, unlabeled protein sequence or structure datasets. While initial protein representation learning studies solely focused on either sequence or structural features, recent hybrid architectures have sought to merge these modalities to harness their respective strengths. However, these sequence-structure models have so far achieved only incremental improvements when compared to the leading sequence-only approaches, highlighting unresolved challenges effectively leveraging these modalities together. Moreover, the function of certain proteins is highly dependent on the granular aspects of their surface topology, which have been overlooked by prior models. To address these limitations, we introduce the Sequence-Structure-Surface Fitness (S3F) model -- a novel multimodal representation learning framework that integrates protein features across several scales. Our approach combines sequence representations from a protein language model with Geometric Vector Perceptron networks encoding protein backbone and detailed surface topology. The proposed method achieves state-of-the-art fitness prediction on the ProteinGym benchmark encompassing 217 substitution deep mutational scanning assays, and provides insights into the determinants of protein function.
Scaling Diffusion Policy in Transformer to 1 Billion Parameters for Robotic Manipulation
Zhu, Minjie, Zhu, Yichen, Li, Jinming, Wen, Junjie, Xu, Zhiyuan, Liu, Ning, Cheng, Ran, Shen, Chaomin, Peng, Yaxin, Feng, Feifei, Tang, Jian
Diffusion Policy is a powerful technique tool for learning end-to-end visuomotor robot control. It is expected that Diffusion Policy possesses scalability, a key attribute for deep neural networks, typically suggesting that increasing model size would lead to enhanced performance. However, our observations indicate that Diffusion Policy in transformer architecture (\DP) struggles to scale effectively; even minor additions of layers can deteriorate training outcomes. To address this issue, we introduce Scalable Diffusion Transformer Policy for visuomotor learning. Our proposed method, namely \textbf{\methodname}, introduces two modules that improve the training dynamic of Diffusion Policy and allow the network to better handle multimodal action distribution. First, we identify that \DP~suffers from large gradient issues, making the optimization of Diffusion Policy unstable. To resolve this issue, we factorize the feature embedding of observation into multiple affine layers, and integrate it into the transformer blocks. Additionally, our utilize non-causal attention which allows the policy network to \enquote{see} future actions during prediction, helping to reduce compounding errors. We demonstrate that our proposed method successfully scales the Diffusion Policy from 10 million to 1 billion parameters. This new model, named \methodname, can effectively scale up the model size with improved performance and generalization. We benchmark \methodname~across 50 different tasks from MetaWorld and find that our largest \methodname~outperforms \DP~with an average improvement of 21.6\%. Across 7 real-world robot tasks, our ScaleDP demonstrates an average improvement of 36.25\% over DP-T on four single-arm tasks and 75\% on three bimanual tasks. We believe our work paves the way for scaling up models for visuomotor learning. The project page is available at scaling-diffusion-policy.github.io.
Reaction-conditioned De Novo Enzyme Design with GENzyme
Hua, Chenqing, Lu, Jiarui, Liu, Yong, Zhang, Odin, Tang, Jian, Ying, Rex, Jin, Wengong, Wolf, Guy, Precup, Doina, Zheng, Shuangjia
The introduction of models like RFDiffusionAA, AlphaFold3, AlphaProteo, and Chai1 has revolutionized protein structure modeling and interaction prediction, primarily from a binding perspective, focusing on creating ideal lock-and-key models. However, these methods can fall short for enzyme-substrate interactions, where perfect binding models are rare, and induced fit states are more common. To address this, we shift to a functional perspective for enzyme design, where the enzyme function is defined by the reaction it catalyzes. Here, we introduce \textsc{GENzyme}, a \textit{de novo} enzyme design model that takes a catalytic reaction as input and generates the catalytic pocket, full enzyme structure, and enzyme-substrate binding complex. \textsc{GENzyme} is an end-to-end, three-staged model that integrates (1) a catalytic pocket generation and sequence co-design module, (2) a pocket inpainting and enzyme inverse folding module, and (3) a binding and screening module to optimize and predict enzyme-substrate complexes. The entire design process is driven by the catalytic reaction being targeted. This reaction-first approach allows for more accurate and biologically relevant enzyme design, potentially surpassing structure-based and binding-focused models in creating enzymes capable of catalyzing specific reactions. We provide \textsc{GENzyme} code at https://github.com/WillHua127/GENzyme.
EDT: An Efficient Diffusion Transformer Framework Inspired by Human-like Sketching
Chen, Xinwang, Liu, Ning, Zhu, Yichen, Feng, Feifei, Tang, Jian
Transformer-based Diffusion Probabilistic Models (DPMs) have shown more potential than CNN-based DPMs, yet their extensive computational requirements hinder widespread practical applications. To reduce the computation budget of transformer-based DPMs, this work proposes the Efficient Diffusion Transformer (EDT) framework. The framework includes a lightweight-design diffusion model architecture, and a training-free Attention Modulation Matrix and its alternation arrangement in EDT inspired by human-like sketching. Additionally, we propose a token relation-enhanced masking training strategy tailored explicitly for EDT to augment its token relation learning capability. Our extensive experiments demonstrate the efficacy of EDT. The EDT framework reduces training and inference costs and surpasses existing transformer-based diffusion models in image synthesis performance, thereby achieving a significant overall enhancement. With lower FID, EDT-S, EDT-B, and EDT-XL attained speed-ups of 3.93x, 2.84x, and 1.92x respectively in the training phase, and 2.29x, 2.29x, and 2.22x respectively in inference, compared to the corresponding sizes of MDTv2. The source code is released here.
Discrete Policy: Learning Disentangled Action Space for Multi-Task Robotic Manipulation
Wu, Kun, Zhu, Yichen, Li, Jinming, Wen, Junjie, Liu, Ning, Xu, Zhiyuan, Qiu, Qinru, Tang, Jian
Learning visuomotor policy for multi-task robotic manipulation has been a long-standing challenge for the robotics community. The difficulty lies in the diversity of action space: typically, a goal can be accomplished in multiple ways, resulting in a multimodal action distribution for a single task. The complexity of action distribution escalates as the number of tasks increases. In this work, we propose \textbf{Discrete Policy}, a robot learning method for training universal agents capable of multi-task manipulation skills. Discrete Policy employs vector quantization to map action sequences into a discrete latent space, facilitating the learning of task-specific codes. These codes are then reconstructed into the action space conditioned on observations and language instruction. We evaluate our method on both simulation and multiple real-world embodiments, including both single-arm and bimanual robot settings. We demonstrate that our proposed Discrete Policy outperforms a well-established Diffusion Policy baseline and many state-of-the-art approaches, including ACT, Octo, and OpenVLA. For example, in a real-world multi-task training setting with five tasks, Discrete Policy achieves an average success rate that is 26\% higher than Diffusion Policy and 15\% higher than OpenVLA. As the number of tasks increases to 12, the performance gap between Discrete Policy and Diffusion Policy widens to 32.5\%, further showcasing the advantages of our approach. Our work empirically demonstrates that learning multi-task policies within the latent space is a vital step toward achieving general-purpose agents.