Junchi Yan

Ruizhe Zhong, Xingbo Du, Junchi Yan

Floorplanning determines the coordinate and shape of each module in Integrated Circuits. With the scaling of technology nodes, in floorplanning stage especially 3D scenarios with multiple stacked layers, it has become increasingly challenging to adhere to complex hardware design rules. Current methods are only capable of handling specific and limited design rules, while violations of other rules require manual and meticulous adjustment. This leads to labor-intensive and time-consuming post-processing for expert engineers. In this paper, we propose an all-in-one deep reinforcement learning-based approach to tackle these challenges, and design novel representations for real-world IC design rules that have not been addressed by previous approaches. Specifically, the processing of various hardware design rules is unified into a single framework with three key components: 1) novel matrix representations to model the design rules, 2) constraints on the action space to filter out invalid actions that cause rule violations, and 3) quantitative analysis of constraint satisfaction as reward signals. Experiments on public benchmarks demonstrate the effectiveness and validity of our approach. Furthermore, transferability is well demonstrated on unseen circuits. Our framework is extensible to accommodate new design rules, thus providing flexibility to address emerging challenges in future chip design. Code will be available at: https://github.com/Thinklab-SJTU/EDA-AI

Jian Hu, Jiayi Lin, Junchi Yan et al.

Promptable segmentation typically requires instance-specific manual prompts to guide the segmentation of each desired object. To minimize such a need, task-generic promptable segmentation has been introduced, which employs a single task-generic prompt to segment various images of different objects in the same task. Current methods use Multimodal Large Language Models (MLLMs) to reason detailed instance-specific prompts from a task-generic prompt for improving segmentation accuracy. The effectiveness of this segmentation heavily depends on the precision of these derived prompts. However, MLLMs often suffer hallucinations during reasoning, resulting in inaccurate prompting. While existing methods focus on eliminating hallucinations to improve a model, we argue that MLLM hallucinations can reveal valuable contextual insights when leveraged correctly, as they represent pre-trained large-scale knowledge beyond individual images. In this paper, we utilize hallucinations to mine task-related information from images and verify its accuracy for enhancing precision of the generated prompts. Specifically, we introduce an iterative Prompt-Mask Cycle generation framework (ProMaC) with a prompt generator and a mask generator.The prompt generator uses a multi-scale chain of thought prompting, initially exploring hallucinations for extracting extended contextual knowledge on a test image.These hallucinations are then reduced to formulate precise instance-specific prompts, directing the mask generator to produce masks that are consistent with task semantics by mask semantic alignment. The generated masks iteratively induce the prompt generator to focus more on task-relevant image areas and reduce irrelevant hallucinations, resulting jointly in better prompts and masks. Experiments on 5 benchmarks demonstrate the effectiveness of ProMaC. Code given in https://lwpyh.github.io/ProMaC/.

Qitian Wu, David Wipf, Junchi Yan

Learning representations for structured data with certain geometries (e.g., observed or unobserved) is a fundamental challenge, wherein message passing neural networks (MPNNs) have become a de facto class of model solutions. In this paper, inspired by physical systems, we propose an energy-constrained diffusion model, which integrates the inductive bias of diffusion on manifolds with layer-wise constraints of energy minimization. We identify that the diffusion operators have a one-to-one correspondence with the energy functions implicitly descended by the diffusion process, and the finite-difference iteration for solving the energy-constrained diffusion system induces the propagation layers of various types of MPNNs operating on observed or latent structures. This leads to a unified mathematical framework for common neural architectures whose computational flows can be cast as message passing (or its special case), including MLPs, GNNs, and Transformers. Building on these insights, we devise a new class of neural message passing models, dubbed diffusion-inspired Transformers (DIFFormer), whose global attention layers are derived from the principled energy-constrained diffusion framework. Across diverse datasets ranging from real-world networks to images, texts, and physical particles, we demonstrate that the new model achieves promising performance in scenarios where the data structures are observed (as a graph), partially observed, or entirely unobserved.

Zhenjie Yang, Yilin Chai, Xiaosong Jia et al.

End-to-end autonomous driving (E2E-AD) demands effective processing of multi-view sensory data and robust handling of diverse and complex driving scenarios, particularly rare maneuvers such as aggressive turns. Recent success of Mixture-of-Experts (MoE) architecture in Large Language Models (LLMs) demonstrates that specialization of parameters enables strong scalability. In this work, we propose DriveMoE, a novel MoE-based E2E-AD framework, with a Scene-Specialized Vision MoE and a Skill-Specialized Action MoE. DriveMoE is built upon our $π_0$ Vision-Language-Action (VLA) baseline (originally from the embodied AI field), called Drive-$π_0$. Specifically, we add Vision MoE to Drive-$π_0$ by training a router to select relevant cameras according to the driving context dynamically. This design mirrors human driving cognition, where drivers selectively attend to crucial visual cues rather than exhaustively processing all visual information. In addition, we add Action MoE by training another router to activate specialized expert modules for different driving behaviors. Through explicit behavioral specialization, DriveMoE is able to handle diverse scenarios without suffering from modes averaging like existing models. In Bench2Drive closed-loop evaluation experiments, DriveMoE achieves state-of-the-art (SOTA) performance, demonstrating the effectiveness of combining vision and action MoE in autonomous driving tasks. We will release our code and models of DriveMoE and Drive-$π_0$.

Xiaohan Qin, Xiaoxing Wang, Ning Liao et al.

Multi-Task Learning (MTL) enables a single model to learn multiple tasks simultaneously, leveraging knowledge transfer among tasks for enhanced generalization, and has been widely applied across various domains. However, task imbalance remains a major challenge in MTL. Although balancing the convergence speeds of different tasks is an effective approach to address this issue, it is highly challenging to accurately characterize the training dynamics and convergence speeds of multiple tasks within the complex MTL system. To this end, we attempt to analyze the training dynamics in MTL by leveraging Neural Tangent Kernel (NTK) theory and propose a new MTL method, NTKMTL. Specifically, we introduce an extended NTK matrix for MTL and adopt spectral analysis to balance the convergence speeds of multiple tasks, thereby mitigating task imbalance. Based on the approximation via shared representation, we further propose NTKMTL-SR, achieving training efficiency while maintaining competitive performance. Extensive experiments demonstrate that our methods achieve state-of-the-art performance across a wide range of benchmarks, including both multi-task supervised learning and multi-task reinforcement learning. Source code is available at https://github.com/jianke0604/NTKMTL.

Shaofeng Zhang, Jinfa Huang, Qiang Zhou et al.

Image outpainting aims to generate the content of an input sub-image beyond its original boundaries. It is an important task in content generation yet remains an open problem for generative models. This paper pushes the technical frontier of image outpainting in two directions that have not been resolved in literature: 1) outpainting with arbitrary and continuous multiples (without restriction), and 2) outpainting in a single step (even for large expansion multiples). Moreover, we develop a method that does not depend on a pre-trained backbone network, which is in contrast commonly required by the previous SOTA outpainting methods. The arbitrary multiple outpainting is achieved by utilizing randomly cropped views from the same image during training to capture arbitrary relative positional information. Specifically, by feeding one view and positional embeddings as queries, we can reconstruct another view. At inference, we generate images with arbitrary expansion multiples by inputting an anchor image and its corresponding positional embeddings. The one-step outpainting ability here is particularly noteworthy in contrast to previous methods that need to be performed for $N$ times to obtain a final multiple which is $N$ times of its basic and fixed multiple. We evaluate the proposed approach (called PQDiff as we adopt a diffusion-based generator as our embodiment, under our proposed \textbf{P}ositional \textbf{Q}uery scheme) on public benchmarks, demonstrating its superior performance over state-of-the-art approaches. Specifically, PQDiff achieves state-of-the-art FID scores on the Scenery (\textbf{21.512}), Building Facades (\textbf{25.310}), and WikiArts (\textbf{36.212}) datasets. Furthermore, under the 2.25x, 5x and 11.7x outpainting settings, PQDiff only takes \textbf{40.6\%}, \textbf{20.3\%} and \textbf{10.2\%} of the time of the benchmark state-of-the-art (SOTA) method.

Zhanpeng Zhou, Mingze Wang, Yuchen Mao et al.

Sharpness-Aware Minimization (SAM) has substantially improved the generalization of neural networks under various settings. Despite the success, its effectiveness remains poorly understood. In this work, we discover an intriguing phenomenon in the training dynamics of SAM, shedding light on understanding its implicit bias towards flatter minima over Stochastic Gradient Descent (SGD). Specifically, we find that SAM efficiently selects flatter minima late in training. Remarkably, even a few epochs of SAM applied at the end of training yield nearly the same generalization and solution sharpness as full SAM training. Subsequently, we delve deeper into the underlying mechanism behind this phenomenon. Theoretically, we identify two phases in the learning dynamics after applying SAM late in training: i) SAM first escapes the minimum found by SGD exponentially fast; and ii) then rapidly converges to a flatter minimum within the same valley. Furthermore, we empirically investigate the role of SAM during the early training phase. We conjecture that the optimization method chosen in the late phase is more crucial in shaping the final solution's properties. Based on this viewpoint, we extend our findings from SAM to Adversarial Training.

Andi Han, Wei Huang, Zhanpeng Zhou et al.

Deep learning with noisy labels presents significant challenges. In this work, we theoretically characterize the role of label noise from a feature learning perspective. Specifically, we consider a signal-noise data distribution, where each sample comprises a label-dependent signal and label-independent noise, and rigorously analyze the training dynamics of a two-layer convolutional neural network under this data setup, along with the presence of label noise. Our analysis identifies two key stages. In Stage I, the model perfectly fits all the clean samples (i.e., samples without label noise) while ignoring the noisy ones (i.e., samples with noisy labels). During this stage, the model learns the signal from the clean samples, which generalizes well on unseen data. In Stage II, as the training loss converges, the gradient in the direction of noise surpasses that of the signal, leading to overfitting on noisy samples. Eventually, the model memorizes the noise present in the noisy samples and degrades its generalization ability. Furthermore, our analysis provides a theoretical basis for two widely used techniques for tackling label noise: early stopping and sample selection. Experiments on both synthetic and real-world setups validate our theory.

Mingquan Feng, Zhijie Chen, Yixin Huang et al.

Optimal control problems (OCPs) involve finding a control function for a dynamical system such that a cost functional is optimized. It is central to physical systems in both academia and industry. In this paper, we propose a novel instance-solution control operator perspective, which solves OCPs in a one-shot manner without direct dependence on the explicit expression of dynamics or iterative optimization processes. The control operator is implemented by a new neural operator architecture named Neural Adaptive Spectral Method (NASM), a generalization of classical spectral methods. We theoretically validate the perspective and architecture by presenting the approximation error bounds of NASM for the control operator. Experiments on synthetic environments and a real-world dataset verify the effectiveness and efficiency of our approach, including substantial speedup in running time, and high-quality in- and out-of-distribution generalization.

Zixu Wang, Yuhan Wang, Junfei Ma et al.

This work presents predictive hydrodynamic simulations empowered by artificial intelligence (AI) for laser driven implosion experiments, taking the double-cone ignition (DCI) scheme as an example. A Transformer-based deep learning model MULTI-Net is established to predict implosion features according to laser waveforms and target radius. A Physics-Informed Decoder (PID) is proposed for high-dimensional sampling, significantly reducing the prediction errors compared to Latin hypercube sampling. Applied to DCI experiments conducted on the SG-II Upgrade facility, the MULTI-Net model is able to predict the implosion dynamics measured by the x-ray streak camera. It is found that an effective laser absorption factor about 65\% is suitable for the one-dimensional simulations of the DCI-R10 experiments. For shot 33, the mean implosion velocity and collided plasma density reached 195 km/s and 117 g/cc, respectively. This study demonstrates a data-driven AI framework that enhances the prediction ability of simulations for complicated laser fusion experiments.

Mingquan Feng, Yixin Huang, Yifan Fu et al.

The design of optimization algorithms for neural networks remains a critical challenge, with most existing methods relying on heuristic adaptations of gradient-based approaches. This paper introduces KO (Kinetics-inspired Optimizer), a novel neural optimizer inspired by kinetic theory and partial differential equation (PDE) simulations. We reimagine the training dynamics of network parameters as the evolution of a particle system governed by kinetic principles, where parameter updates are simulated via a numerical scheme for the Boltzmann transport equation (BTE) that models stochastic particle collisions. This physics-driven approach inherently promotes parameter diversity during optimization, mitigating the phenomenon of parameter condensation, i.e. collapse of network parameters into low-dimensional subspaces, through mechanisms analogous to thermal diffusion in physical systems. We analyze this property, establishing both a mathematical proof and a physical interpretation. Extensive experiments on image classification (CIFAR-10/100, ImageNet) and text classification (IMDB, Snips) tasks demonstrate that KO consistently outperforms baseline optimizers (e.g., Adam, SGD), achieving accuracy improvements while computation cost remains comparable.

Shutong Ding, Yimiao Zhou, Ke Hu et al.

Diffusion models have achieved remarkable success in generative tasks such as image and video synthesis, and in control domains like robotics, owing to their strong generalization capabilities and proficiency in fitting complex multimodal distributions. However, their full potential in solving Continuous Constrained Optimization problems remains largely underexplored. Our work commences by investigating a two-dimensional constrained quadratic optimization problem as an illustrative example to explore the inherent challenges and issues when applying diffusion models to such optimization tasks and providing theoretical analyses for these observations. To address the identified gaps and harness diffusion models for Continuous Constrained Optimization, we build upon this analysis to propose a novel diffusion-based framework for optimization problems called DiOpt. This framework operates in two distinct phases: an initial warm-start phase, implemented via supervised learning, followed by a bootstrapping phase. This dual-phase architecture is designed to iteratively refine solutions, thereby improving the objective function while rigorously satisfying problem constraints. Finally, multiple candidate solutions are sampled, and the optimal one is selected through a screening process. We present extensive experiments detailing the training dynamics of DiOpt, its performance across a diverse set of Continuous Constrained Optimization problems, and an analysis of the impact of DiOpt's various hyperparameters.