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新论文 · v1arXiv:2611.03595

DynaSolver: A Neural Operator for Autoregressive 4D Flow Prediction with Dynamic Boundaries

Rui Qian, Shibo Dai, Mengjun Lin, Yuk-Kit Hou, Saining Zhang, Bohan Li, Junhao Chen, Hao Zhao 等 9 位作者

Neural operators provide efficient surrogates for computational fluid dynamics (CFD), but most are designed for static geometries and are not equipped to model unsteady flows induced by continuously moving boundaries. We study dynamic-boundary 4D CFD prediction for articulated moving geometries and introduce RoboCFD-4D, a temporally resolved robotic CFD benchmark spanning diverse morphologies and flow conditions. To address the computational and autoregressive challenges of this setting, we propose DynaSolver, a neural operator that explicitly conditions on boundary evolution and causal flow history. DynaSolver employs an efficient physical-token formulation that amortizes point-to-token projection across the operator stack, substantially reducing repeated point-space spatio-temporal computation while retaining accurate point-level reconstruction. We further introduce Replay-Augmented Parallel Training, which exposes the model to autoregressively generated histories while preserving parallel dense supervision, narrowing the gap between ground-truth-conditioned training and autoregressive rollout. Experiments on RoboCFD-4D show that DynaSolver achieves the best full-rollout accuracy among a broad range of learned CFD surrogates, with its advantage increasing as rollout proceeds, indicating substantially reduced autoregressive error accumulation. Project page: https://made-gpt.github.io/DynaSolver-ProjectPage.

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cs.LG
arXiv ↗PDF ↗
版本更新 · v2arXiv:2607.15880

Dynamics-Aware Meta-Imitation for Generalization to Unseen Robotic Manipulation

Zhenduo Shang, Xiyao Liu, Bohan Li, Xudong Wang, Teng Ren, Lianqing Liu, Zhi Han

Imitation Learning aims to learn skills from extensive observations and demonstrations for robots, so it suffers from data scarcity and environment generalization. The existing methods predominantly focus on imitation from in-domain tasks and consequently struggle with generalization to unseen tasks. To bridge this generalization gap, we propose the \textbf{D}ynamics-\textbf{A}ware \textbf{M}eta-\textbf{I}mitation (DAMI) framework. By integrating meta-learning to construct a shared skill space, DAMI equips agents for rapid adaptation to novel tasks. We introduce the Visual-Motor Trajectory (VMT) module to capture complex spatio-temporal dynamics within the task latent space. Furthermore, we propose the Unpaired Unified Task (U2T) block to fuse unstructured multimodal observations. To coordinate these representations, we integrate a Task-Conditioned Feature Modulation (TCFM) mechanism customized for modulating low-level 3D features. By capturing intrinsic dynamics from a random complete reference demonstration, our framework learns the underlying task logic rather than memorizing static cues, ensuring effective generalization. Extensive experiments in both simulation and real-world settings demonstrate that our approach outperforms state-of-the-art baselines regarding direct inference on seen tasks and adaptation to unseen tasks via few-shot fine-tuning.

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cs.RO · cs.LG
arXiv ↗PDF ↗
新论文 · v1arXiv:2610.36226

Structure, Not Sequence: Tracking and Validating Folding Mechanisms in ESMFold's Trunk with Sparse Autoencoders

Bohan Liu, Xiaohan Fan, Wenqian Ye, Aidong Zhang

Structure predictors like ESMFold fold proteins using neural network computation and have transformed structural biology. However, the driving mechanism from amino-acid (AA) sequence to 3D structure is insufficiently understood, and biological meaning remains locked in the dense network. Sparse autoencoders (SAEs) have shown promising results in obtaining interpretable concept features over an overcomplete basis of intermediate protein sequence-model representations. Yet folding models, which predict physical shape from AA sequence semantics, have no such account. We hypothesize that the features carrying the folding computation evolve in the 3D structural regression process. In this paper, we interpret the folding trunk in three steps. First, a pilot analysis on the representation distribution across modules and recycles locates distinct spatial computation in the trunk. Second, the dictionaries expose a division of labor: the single representation carries inherited semantics, and the pair representation computes the pairwise geometry. Third, we interpret the dictionary at scale with a reasoning language model, trace how the concepts compose across blocks by gradient-based attribution, and follow the interpreted code to the model's folding output, verifying where the computation aligns with, or departs from, known biochemistry. Together, the sparse dictionaries we train capture the relational geometry the trunk computes beyond the sequence model, and their concept activations forecast the model's own fold quality, turning the black-box folding trunk into a sparse, interpretable, and scientifically verifiable circuit.

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q-bio.QM · cs.AI · cs.LG
arXiv ↗PDF ↗