Graph Neural Networks (GNNs) have demonstrated strong performance in graph representation learning across various real-world applications. However, they often produce biased predictions caused by sensitive attributes, such as religion or gender, an issue that has been largely overlooked in existing methods. Recently, numerous studies have focused on reducing biases in GNNs. However, these approaches often rely on training with partial data (e.g., using either node features or graph structure alone), which can enhance fairness but frequently compromises model utility due to the limited utilization of available graph information. To address this tradeoff, we propose an effective strategy to balance fairness and utility in knowledge distillation. Specifically, we introduce FairDTD, a novel Fair representation learning framework built on Dual-Teacher Distillation, leveraging a causal graph model to guide and optimize the design of the distillation process. Specifically, FairDTD employs two fairness-oriented teacher models: a feature teacher and a structure teacher, to facilitate dual distillation, with the student model learning fairness knowledge from the teachers while also leveraging full data to mitigate utility loss. To enhance information transfer, we incorporate graph-level distillation to provide an indirect supplement of graph information during training, as well as a node-specific temperature module to improve the comprehensive transfer of fair knowledge. Experiments on diverse benchmark datasets demonstrate that FairDTD achieves optimal fairness while preserving high model utility, showcasing its effectiveness in fair representation learning for GNNs.

Despite the recent advancements of vision-language-action (VLA) models on a variety of robotics tasks, they suffer from critical issues such as poor generalizability to unseen tasks, due to their reliance on behavior cloning exclusively from successful rollouts. Furthermore, they are typically fine-tuned to replicate demonstrations collected by experts under different settings, thus introducing distribution bias and limiting their adaptability to diverse manipulation objectives, such as efficiency, safety, and task completion. To bridge this gap, we introduce GRAPE: Generalizing Robot Policy via Preference Alignment. Specifically, GRAPE aligns VLAs on a trajectory level and implicitly models reward from both successful and failure trials to boost generalizability to diverse tasks. Moreover, GRAPE breaks down complex manipulation tasks to independent stages and automatically guides preference modeling through customized spatiotemporal constraints with keypoints proposed by a large vision-language model. Notably, these constraints are flexible and can be customized to align the model with varying objectives, such as safety, efficiency, or task success. We evaluate GRAPE across a diverse array of tasks in both real-world and simulated environments. Experimental results demonstrate that GRAPE enhances the performance of state-of-the-art VLA models, increasing success rates on in-domain and unseen manipulation tasks by 51.79% and 60.36%, respectively. Additionally, GRAPE can be aligned with various objectives, such as safety and efficiency, reducing collision rates by 44.31% and rollout step-length by 11.15%, respectively. All code, models, and data are available at https://grape-vla.github.io/

Contact force in contact-rich environments is an essential modality for robots to perform general-purpose manipulation tasks, as it provides information to compensate for the deficiencies of visual and proprioceptive data in collision perception, high-precision grasping, and efficient manipulation. In this paper, we propose an admittance visuomotor policy framework for continuous, general-purpose, contact-rich manipulations. During demonstrations, we designed a low-cost, user-friendly teleoperation system with contact interaction, aiming to gather compliant robot demonstrations and accelerate the data collection process. During training and inference, we propose a diffusion-based model to plan action trajectories and desired contact forces from multimodal observation that includes contact force, vision and proprioception. We utilize an admittance controller for compliance action execution. A comparative evaluation with two state-of-the-art methods was conducted on five challenging tasks, each focusing on different action primitives, to demonstrate our framework's generalization capabilities. Results show our framework achieves the highest success rate and exhibits smoother and more efficient contact compared to other methods, the contact force required to complete each tasks was reduced on average by 48.8%, and the success rate was increased on average by 15.3%. Videos are available at https://ryanjiao.github.io/AdmitDiffPolicy/.

Graph neural networks (GNNs) have become essential tools for analyzing non-Euclidean data across various domains. During training stage, sampling plays an important role in reducing latency by limiting the number of nodes processed, particularly in large-scale applications. However, as the demand for better prediction performance grows, existing sampling algorithms become increasingly complex, leading to significant overhead. To mitigate this, we propose YOSO (You-Only-Sample-Once), an algorithm designed to achieve efficient training while preserving prediction accuracy. YOSO introduces a compressed sensing (CS)-based sampling and reconstruction framework, where nodes are sampled once at input layer, followed by a lossless reconstruction at the output layer per epoch. By integrating the reconstruction process with the loss function of specific learning tasks, YOSO not only avoids costly computations in traditional compressed sensing (CS) methods, such as orthonormal basis calculations, but also ensures high-probability accuracy retention which equivalent to full node participation. Experimental results on node classification and link prediction demonstrate the effectiveness and efficiency of YOSO, reducing GNN training by an average of 75\% compared to state-of-the-art methods, while maintaining accuracy on par with top-performing baselines.

In warehouse environments, robots require robust picking capabilities to manage a wide variety of objects. Effective deployment demands minimal hardware, strong generalization to new products, and resilience in diverse settings. Current methods often rely on depth sensors for structural information, which suffer from high costs, complex setups, and technical limitations. Inspired by recent advancements in computer vision, we propose an innovative approach that leverages foundation models to enhance suction grasping using only RGB images. Trained solely on a synthetic dataset, our method generalizes its grasp prediction capabilities to real-world robots and a diverse range of novel objects not included in the training set. Our network achieves an 82.3\% success rate in real-world applications. The project website with code and data will be available at http://optigrasp.github.io.

There is a growing interest in the role that LLMs play in chemistry which lead to an increased focus on the development of LLMs benchmarks tailored to chemical domains to assess the performance of LLMs across a spectrum of chemical tasks varying in type and complexity. However, existing benchmarks in this domain fail to adequately meet the specific requirements of chemical research professionals. To this end, we propose \textbf{\textit{ChemEval}}, which provides a comprehensive assessment of the capabilities of LLMs across a wide range of chemical domain tasks. Specifically, ChemEval identified 4 crucial progressive levels in chemistry, assessing 12 dimensions of LLMs across 42 distinct chemical tasks which are informed by open-source data and the data meticulously crafted by chemical experts, ensuring that the tasks have practical value and can effectively evaluate the capabilities of LLMs. In the experiment, we evaluate 12 mainstream LLMs on ChemEval under zero-shot and few-shot learning contexts, which included carefully selected demonstration examples and carefully designed prompts. The results show that while general LLMs like GPT-4 and Claude-3.5 excel in literature understanding and instruction following, they fall short in tasks demanding advanced chemical knowledge. Conversely, specialized LLMs exhibit enhanced chemical competencies, albeit with reduced literary comprehension. This suggests that LLMs have significant potential for enhancement when tackling sophisticated tasks in the field of chemistry. We believe our work will facilitate the exploration of their potential to drive progress in chemistry. Our benchmark and analysis will be available at {\color{blue} \url{https://github.com/USTC-StarTeam/ChemEval}}.

We study active learning methods for single index models of the form $F({\mathbf x}) = f(\langle {\mathbf w}, {\mathbf x}\rangle)$, where $f:\mathbb{R} \to \mathbb{R}$ and ${\mathbf x,\mathbf w} \in \mathbb{R}^d$. In addition to their theoretical interest as simple examples of non-linear neural networks, single index models have received significant recent attention due to applications in scientific machine learning like surrogate modeling for partial differential equations (PDEs). Such applications require sample-efficient active learning methods that are robust to adversarial noise. I.e., that work even in the challenging agnostic learning setting. We provide two main results on agnostic active learning of single index models. First, when $f$ is known and Lipschitz, we show that $\tilde{O}(d)$ samples collected via {statistical leverage score sampling} are sufficient to learn a near-optimal single index model. Leverage score sampling is simple to implement, efficient, and already widely used for actively learning linear models. Our result requires no assumptions on the data distribution, is optimal up to log factors, and improves quadratically on a recent ${O}(d^{2})$ bound of \cite{gajjar2023active}. Second, we show that $\tilde{O}(d)$ samples suffice even in the more difficult setting when $f$ is \emph{unknown}. Our results leverage tools from high dimensional probability, including Dudley's inequality and dual Sudakov minoration, as well as a novel, distribution-aware discretization of the class of Lipschitz functions.

As the use of Deep Neural Networks (DNNs) becomes pervasive, their vulnerability to adversarial attacks and limitations in handling unseen classes poses significant challenges. The state-of-the-art offers discrete solutions aimed to tackle individual issues covering specific adversarial attack scenarios, classification or evolving learning. However, real-world systems need to be able to detect and recover from a wide range of adversarial attacks without sacrificing classification accuracy and to flexibly act in {\bf unseen} scenarios. In this paper, UNICAD, is proposed as a novel framework that integrates a variety of techniques to provide an adaptive solution. For the targeted image classification, UNICAD achieves accurate image classification, detects unseen classes, and recovers from adversarial attacks using Prototype and Similarity-based DNNs with denoising autoencoders. Our experiments performed on the CIFAR-10 dataset highlight UNICAD's effectiveness in adversarial mitigation and unseen class classification, outperforming traditional models.

Leveraging the development of structural causal model (SCM), researchers can establish graphical models for exploring the causal mechanisms behind machine learning techniques. As the complexity of machine learning applications rises, single-world interventionism causal analysis encounters theoretical adaptation limitations. Accordingly, cross-world counterfactual approach extends our understanding of causality beyond observed data, enabling hypothetical reasoning about alternative scenarios. However, the joint involvement of cross-world variables, encompassing counterfactual variables and real-world variables, challenges the construction of the graphical model. Twin network is a subtle attempt, establishing a symbiotic relationship, to bridge the gap between graphical modeling and the introduction of counterfactuals albeit with room for improvement in generalization. In this regard, we demonstrate the theoretical breakdowns of twin networks in certain cross-world counterfactual scenarios. To this end, we propose a novel teleporter theory to establish a general and simple graphical representation of counterfactuals, which provides criteria for determining teleporter variables to connect multiple worlds. In theoretical application, we determine that introducing the proposed teleporter theory can directly obtain the conditional independence between counterfactual variables and real-world variables from the cross-world SCM without requiring complex algebraic derivations. Accordingly, we can further identify counterfactual causal effects through cross-world symbolic derivation. We demonstrate the generality of the teleporter theory to the practical application. Adhering to the proposed theory, we build a plug-and-play module, and the effectiveness of which are substantiated by experiments on benchmarks.

Multi-modal methods establish comprehensive superiority over uni-modal methods. However, the imbalanced contributions of different modalities to task-dependent predictions constantly degrade the discriminative performance of canonical multi-modal methods. Based on the contribution to task-dependent predictions, modalities can be identified as predominant and auxiliary modalities. Benchmark methods raise a tractable solution: augmenting the auxiliary modality with a minor contribution during training. However, our empirical explorations challenge the fundamental idea behind such behavior, and we further conclude that benchmark approaches suffer from certain defects: insufficient theoretical interpretability and limited exploration capability of discriminative knowledge. To this end, we revisit multi-modal representation learning from a causal perspective and build the Structural Causal Model. Following the empirical explorations, we determine to capture the true causality between the discriminative knowledge of predominant modality and predictive label while considering the auxiliary modality. Thus, we introduce the $\beta$-generalization front-door criterion. Furthermore, we propose a novel network for sufficiently exploring multi-modal discriminative knowledge. Rigorous theoretical analyses and various empirical evaluations are provided to support the effectiveness of the innate mechanism behind our proposed method.