Many training data attribution (TDA) methods aim to estimate how a model's behavior would change if one or more data points were removed from the training set. Methods based on implicit differentiation, such as influence functions, can be made computationally efficient, but fail to account for underspecification, the implicit bias of the optimization algorithm, or multi-stage training pipelines. By contrast, methods based on unrolling address these issues but face scalability challenges.

This paper presents a novel optimization framework to address key challenges presented by modern machine learning applications: High dimensionality, distributional uncertainty, and data heterogeneity. Our approach unifies regularized estimation, distributionally robust optimization (DRO), and hierarchical Bayesian modeling in a single data-driven criterion. By employing a hierarchical Dirichlet process (HDP) prior, the method effectively handles multi-source data, achieving regularization, distributional robustness, and borrowing strength across diverse yet related data-generating processes. We demonstrate the method's advantages by establishing theoretical performance guarantees and tractable Monte Carlo approximations based on Dirichlet process (DP) theory. Numerical experiments validate the framework's efficacy in improving and stabilizing both prediction and parameter estimation accuracy, showcasing its potential for application in complex data environments.

A flexible active safety motion (FASM) control approach is proposed for the avoidance of dynamic obstacles and the reference tracking in robot manipulators. The distinctive feature of the proposed method lies in its utilization of control barrier functions (CBF) to design flexible CBF-guided safety criteria (CBFSC) with dynamically optimized decay rates, thereby offering flexibility and active safety for robot manipulators in dynamic environments. First, discrete-time CBFs are employed to formulate the novel flexible CBFSC with dynamic decay rates for robot manipulators. Following that, the model predictive control (MPC) philosophy is applied, integrating flexible CBFSC as safety constraints into the receding-horizon optimization problem. Significantly, the decay rates of the designed CBFSC are incorporated as decision variables in the optimization problem, facilitating the dynamic enhancement of flexibility during the obstacle avoidance process. In particular, a novel cost function that integrates a penalty term is designed to dynamically adjust the safety margins of the CBFSC. Finally, experiments are conducted in various scenarios using a Universal Robots 5 (UR5) manipulator to validate the effectiveness of the proposed approach.

Learning-based methods have become increasingly popular for solving vehicle routing problems due to their near-optimal performance and fast inference speed. Among them, the combination of deep reinforcement learning and graph representation allows for the abstraction of node topology structures and features in an encoder-decoder style. Such an approach makes it possible to solve routing problems end-to-end without needing complicated heuristic operators designed by domain experts. Existing research studies have been focusing on novel encoding and decoding structures via various neural network models to enhance the node embedding representation. Despite the sophisticated approaches applied, there is a noticeable lack of consideration for the graph-theoretic properties inherent to routing problems. Moreover, the potential ramifications of inter-nodal interactions on the decision-making efficacy of the models have not been adequately explored. To bridge this gap, we propose an adaptive Graph Attention Sampling with the Edges Fusion framework (GASE),where nodes' embedding is determined through attention calculation from certain highly correlated neighbourhoods and edges, utilizing a filtered adjacency matrix. In detail, the selections of particular neighbours and adjacency edges are led by a multi-head attention mechanism, contributing directly to the message passing and node embedding in graph attention sampling networks. Furthermore, we incorporate an adaptive actor-critic algorithm with policy improvements to expedite the training convergence. We then conduct comprehensive experiments against baseline methods on learning-based VRP tasks from different perspectives. Our proposed model outperforms the existing methods by 2.08\%-6.23\% and shows stronger generalization ability, achieving state-of-the-art performance on randomly generated instances and real-world datasets.

The rapid development of computation power and machine learning algorithms has paved the way for automating scientific discovery with a scanning probe microscope (SPM). The key elements towards operationalization of automated SPM are the interface to enable SPM control from Python codes, availability of high computing power, and development of workflows for scientific discovery. Here we build a Python interface library that enables controlling an SPM from either a local computer or a remote high-performance computer (HPC), which satisfies the high computation power need of machine learning algorithms in autonomous workflows. We further introduce a general platform to abstract the operations of SPM in scientific discovery into fixed-policy or reward-driven workflows. Our work provides a full infrastructure to build automated SPM workflows for both routine operations and autonomous scientific discovery with machine learning.

Quantum Computing aims to streamline machine learning, making it more effective with fewer trainable parameters. This reduction of parameters can speed up the learning process and reduce the use of computational resources. However, in the current phase of quantum computing development, known as the noisy intermediate-scale quantum era (NISQ), learning is difficult due to a limited number of qubits and widespread quantum noise. To overcome these challenges, researchers are focusing on variational quantum circuits (VQCs). VQCs are hybrid algorithms that merge a quantum circuit, which can be adjusted through parameters, with traditional classical optimization techniques. These circuits require only few qubits for effective learning. Recent studies have presented new ways of applying VQCs to reinforcement learning, showing promising results that warrant further exploration. This study investigates the effects of various techniques -- data re-uploading, input scaling, output scaling -- and introduces exponential learning rate decay in the quantum proximal policy optimization algorithm's actor-VQC. We assess these methods in the popular Frozen Lake and Cart Pole environments. Our focus is on their ability to reduce the number of parameters in the VQC without losing effectiveness. Our findings indicate that data re-uploading and an exponential learning rate decay significantly enhance hyperparameter stability and overall performance. While input scaling does not improve parameter efficiency, output scaling effectively manages greediness, leading to increased learning speed and robustness.

Multi-edge cooperative computing that combines constrained resources of multiple edges into a powerful resource pool has the potential to deliver great benefits, such as a tremendous computing power, improved response time, more diversified services. However, the mass heterogeneous resources composition and lack of scheduling strategies make the modeling and cooperating of multi-edge computing system particularly complicated. This paper first proposes a system-level state evaluation model to shield the complex hardware configurations and redefine the different service capabilities at heterogeneous edges. Secondly, an integer linear programming model is designed to cater for optimally dispatching the distributed arriving requests. Finally, a learning-based lightweight real-time scheduler, CoRaiS, is proposed. CoRaiS embeds the real-time states of multi-edge system and requests information, and combines the embeddings with a policy network to schedule the requests, so that the response time of all requests can be minimized. Evaluation results verify that CoRaiS can make a high-quality scheduling decision in real time, and can be generalized to other multi-edge computing system, regardless of system scales. Characteristic validation also demonstrates that CoRaiS successfully learns to balance loads, perceive real-time state and recognize heterogeneity while scheduling.

M${}^{\natural}$-concave functions, a.k.a. gross substitute valuation functions, play a fundamental role in many fields, including discrete mathematics and economics. In practice, perfect knowledge of M${}^{\natural}$-concave functions is often unavailable a priori, and we can optimize them only interactively based on some feedback. Motivated by such situations, we study online M${}^{\natural}$-concave function maximization problems, which are interactive versions of the problem studied by Murota and Shioura (1999). For the stochastic bandit setting, we present $O(T^{-1/2})$-simple regret and $O(T^{2/3})$-regret algorithms under $T$ times access to unbiased noisy value oracles of M${}^{\natural}$-concave functions. A key to proving these results is the robustness of the greedy algorithm to local errors in M${}^{\natural}$-concave function maximization, which is one of our main technical results. While we obtain those positive results for the stochastic setting, another main result of our work is an impossibility in the adversarial setting. We prove that, even with full-information feedback, no algorithms that run in polynomial time per round can achieve $O(T^{1-c})$ regret for any constant $c > 0$ unless $\mathsf{P} = \mathsf{NP}$. Our proof is based on a reduction from the matroid intersection problem for three matroids, which would be a novel idea in the context of online learning.

Superquantiles have recently gained significant interest as a risk-aware metric for addressing fairness and distribution shifts in statistical learning and decision making problems. This paper introduces a fast, scalable and robust second-order computational framework to solve large-scale optimization problems with superquantile-based constraints. Unlike empirical risk minimization, superquantile-based optimization requires ranking random functions evaluated across all scenarios to compute the tail conditional expectation. While this tail-based feature might seem computationally unfriendly, it provides an advantageous setting for a semismooth-Newton-based augmented Lagrangian method. The superquantile operator effectively reduces the dimensions of the Newton systems since the tail expectation involves considerably fewer scenarios. Notably, the extra cost of obtaining relevant second-order information and performing matrix inversions is often comparable to, and sometimes even less than, the effort required for gradient computation. Our developed solver is particularly effective when the number of scenarios substantially exceeds the number of decision variables. In synthetic problems with linear and convex diagonal quadratic objectives, numerical experiments demonstrate that our method outperforms existing approaches by a large margin: It achieves speeds more than 750 times faster for linear and quadratic objectives than the alternating direction method of multipliers as implemented by OSQP for computing low-accuracy solutions. Additionally, it is up to 25 times faster for linear objectives and 70 times faster for quadratic objectives than the commercial solver Gurobi, and 20 times faster for linear objectives and 30 times faster for quadratic objectives than the Portfolio Safeguard optimization suite for high-accuracy solution computations.

Federated learning (FL) has received significant attention in recent years for its advantages in efficient training of machine learning models across distributed clients without disclosing user-sensitive data. Specifically, in federated edge learning (FEEL) systems, the time-varying nature of wireless channels introduces inevitable system dynamics in the communication process, thereby affecting training latency and energy consumption. In this work, we further consider a streaming data scenario where new training data samples are randomly generated over time at edge devices. Our goal is to develop a dynamic scheduling and resource allocation algorithm to address the inherent randomness in data arrivals and resource availability under long-term energy constraints. To achieve this, we formulate a stochastic network optimization problem and use the Lyapunov drift-plus-penalty framework to obtain a dynamic resource management design. Our proposed algorithm makes adaptive decisions on device scheduling, computational capacity adjustment, and allocation of bandwidth and transmit power in every round. We provide convergence analysis for the considered setting with heterogeneous data and time-varying objective functions, which supports the rationale behind our proposed scheduling design. The effectiveness of our scheme is verified through simulation results, demonstrating improved learning performance and energy efficiency as compared to baseline schemes.