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Xuefeng Liu

Xuefeng Liu contributes to research discovery and scholarly infrastructure.

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Published work

11 published item(s)

preprint2026arXiv

From Coordinate Matching to Structural Alignment: Rethinking Prototype Alignment in Heterogeneous Federated Learning

Heterogeneous federated learning (HtFL) aims to enable collaboration among clients that differ in both data distributions and model architectures. Prototype-based methods, which communicate class-level feature centers (prototypes) instead of full model parameters, have recently shown strong potential for HtFL. Existing prototype-based HtFL methods typically reuse the MSE-based or cosine-based alignment mechanism developed for homogeneous FL when aligning client-specific representations with global prototypes. These approaches are essentially coordinate alignment, where representations of clients are forced to match the global prototypes in the embedding space in an element-wise manner. Such alignment implicitly assumes that all clients should map their representations into the feature subspace defined by the global prototypes. This assumption is reasonable in homogeneous FL, where all clients share the same feature extractor. However, it becomes problematic in HtFL, since heterogeneous feature extractors naturally induce client-specific feature subspaces, and forcing all clients to optimize within a single global subspace unnecessarily suppresses their learning capacity. We observe that coordinate alignment implicitly couples two distinct objectives: aligning inter-class semantic structure, which is directly beneficial for classification, and enforcing a shared feature basis, which is unnecessary and even harmful under model heterogeneity. Building on this insight, we design FedSAF, which shifts the alignment objective from absolute coordinates to inter-class relational structure. We demonstrate that structural alignment consistently outperforms coordinate alignment in heterogeneous settings. Experiments on multiple benchmarks show that our structural alignment outperforms state-of-the-art prototype-based HtFL methods by up to 3.52\%.

preprint2025arXiv

STED and Consistency Scoring: A Framework for Evaluating LLM Structured Output Reliability

Large Language Models (LLMs) are increasingly deployed for structured data generation, yet output consistency remains critical for production applications. We introduce a comprehensive framework for evaluating and improving consistency in LLM-generated structured outputs. Our approach combines: (1) STED (Semantic Tree Edit Distance), a novel similarity metric balancing semantic flexibility with structural strictness when comparing JSON outputs, and (2) a consistency scoring framework aggregating multiple STED measurements across repeated generations to quantify reliability. Through systematic experiments on synthetic datasets with controlled schema, expression, and semantic variations, we demonstrate STED achieves superior performance ($0.86-0.90$ similarity for semantic equivalents, $0.0$ for structural breaks) compared to existing metrics including TED, BERTScore, and DeepDiff. Applying our framework to benchmark six LLMs reveals significant variations: Claude-3.7-Sonnet demonstrates exceptional consistency, maintaining near-perfect structural reliability even at high temperatures ($T=0.9$), while models like Claude-3-Haiku and Nova-Pro exhibit substantial degradation requiring careful tuning. Our framework enables practical applications including targeted model selection for structured tasks, iterative prompt refinement for reproducible results, and diagnostic analysis to identify inconsistency root causes. This work provides theoretical foundations and practical tools for ensuring reliable structured output generation in LLM-based production systems.

preprint2022arXiv

Fully computable a posteriori error bounds for eigenfunctions

For compact self-adjoint operators in Hilbert spaces, two algorithms are proposed to provide fully computable a posteriori error estimate for eigenfunction approximation. Both algorithms apply well to the case of tight clusters and multiple eigenvalues, under the settings of target eigenvalue problems. Algorithm I is based on the Rayleigh quotient and the min-max principle that characterizes the eigenvalue problems. The formula for the error estimate provided by Algorithm I is easy to compute and applies to problems with limited information of Rayleigh quotients. Algorithm II, as an extension of the Davis--Kahan method, takes advantage of the dual formulation of differential operators along with the Prager--Synge technique and provides greatly improved accuracy of the estimate, especially for the finite element approximations of eigenfunctions. Numerical examples of eigenvalue problems of matrices and the Laplace operators over convex and non-convex domains illustrate the efficiency of the proposed algorithms.

preprint2022arXiv

Stepped-height ridge waveguide MQW polarization mode converter monolithically integrated with sidewall grating DFB laser

We report the first demonstration of a 1555 nm stepped-height ridge waveguide polarization mode converter monolithically integrated with a side wall grating distributed-feedback (DFB) laser using the identical epitaxial layer scheme. The device shows stable single longitudinal mode (SLM) operation with the output light converted from TE to TM polarization with an efficiency of >94% over a wide range of DFB injection currents (IDFB) from 140 mA to 190 mA. The highest TM mode purity of 98.2% was obtained at IDFB=180 mA. A particular advantage of this device is that only a single step of metalorganic vapor-phase epitaxy and two steps of III-V material dry etching are required for the whole integrated device fabrication, significantly reducing complexity and cost.

preprint2021arXiv

A Survey on Incorporating Domain Knowledge into Deep Learning for Medical Image Analysis

Although deep learning models like CNNs have achieved great success in medical image analysis, the small size of medical datasets remains a major bottleneck in this area. To address this problem, researchers have started looking for external information beyond current available medical datasets. Traditional approaches generally leverage the information from natural images via transfer learning. More recent works utilize the domain knowledge from medical doctors, to create networks that resemble how medical doctors are trained, mimic their diagnostic patterns, or focus on the features or areas they pay particular attention to. In this survey, we summarize the current progress on integrating medical domain knowledge into deep learning models for various tasks, such as disease diagnosis, lesion, organ and abnormality detection, lesion and organ segmentation. For each task, we systematically categorize different kinds of medical domain knowledge that have been utilized and their corresponding integrating methods. We also provide current challenges and directions for future research.

preprint2021arXiv

Computer-assisted proof for the stationary solution existence of the Navier-Stokes equation over 3D domains

This paper proposes a computer-assisted solution existence verification method for the stationary Navier-Stokes equation over general 3D domains. The proposed method verifies that the exact solution as the fixed point of the Newton iteration exists around the approximate solution through rigorous computation and error estimation. The explicit values of quantities required by applying the fixed point theorem are obtained by utilizing newly developed quantitative error estimation for finite element solutions to boundary value problems and eigenvalue problems of the Stokes equation.

preprint2020arXiv

A Deep-learning-based Method for PIR-based Multi-person Localization

Device-free localization (DFL) based on pyroelectric infrared (PIR) sensors has attracted much attention due to its advantages of low cost, low power consumption, and privacy protection. However, most existing PIR-based DFL methods require high deployment density to achieve high localization accuracy. Recently, a few works proposed that the deployment density can be reduced by deeply analyzing the analog output of PIR sensors. However, these methods can not well handle the localization task in multi-person scenarios yet. In this paper, we propose a novel neural network for PIR-based multi-person localization, which appropriately leverages a series of domain knowledge. Specifically, the proposed network consists of two modules: one is for determining the number of persons and another is for determining their locations. Meanwhile, the module of person counting is further designed as a two-stage network: one stage is for signal separation and another is for single-person detection. The module for localization is also designed as a two-stage network: one stage is for signal extraction and another is for single-person localization. Through the above methods, we succeed to remarkably reduce the deployment density of the traditional PIR-based method by about 76\%, while maintaining the localization accuracy.

preprint2020arXiv

Explicit a posteriori and a priori error estimation for the finite element solution of Stokes equations

For the Stokes equation over 2D and 3D domains, explicit a posteriori and a priori error estimation are novelly developed for the finite element solution. The difficulty in handling the divergence-free condition of the Stokes equation is solved by utilizing the extended hypercircle method along with the Scott-Vogelius finite element scheme. Since all terms in the error estimation have explicit values, by further applying the interval arithmetic and verified computing algorithms, the computed results provide rigorous estimation for the approximation error. As an application of the proposed error estimation, the eigenvalue problem of the Stokes operator is considered and rigorous bounds for the eigenvalues are obtained. The efficiency of proposed error estimation is demonstrated by solving the Stokes equation on both convex and non-convex 3D domains.

preprint2020arXiv

Network Adjustment: Channel Search Guided by FLOPs Utilization Ratio

Automatic designing computationally efficient neural networks has received much attention in recent years. Existing approaches either utilize network pruning or leverage the network architecture search methods. This paper presents a new framework named network adjustment, which considers network accuracy as a function of FLOPs, so that under each network configuration, one can estimate the FLOPs utilization ratio (FUR) for each layer and use it to determine whether to increase or decrease the number of channels on the layer. Note that FUR, like the gradient of a non-linear function, is accurate only in a small neighborhood of the current network. Hence, we design an iterative mechanism so that the initial network undergoes a number of steps, each of which has a small `adjusting rate' to control the changes to the network. The computational overhead of the entire search process is reasonable, i.e., comparable to that of re-training the final model from scratch. Experiments on standard image classification datasets and a wide range of base networks demonstrate the effectiveness of our approach, which consistently outperforms the pruning counterpart. The code is available at https://github.com/danczs/NetworkAdjustment.

preprint2020arXiv

SelectScale: Mining More Patterns from Images via Selective and Soft Dropout

Convolutional neural networks (CNNs) have achieved remarkable success in image recognition. Although the internal patterns of the input images are effectively learned by the CNNs, these patterns only constitute a small proportion of useful patterns contained in the input images. This can be attributed to the fact that the CNNs will stop learning if the learned patterns are enough to make a correct classification. Network regularization methods like dropout and SpatialDropout can ease this problem. During training, they randomly drop the features. These dropout methods, in essence, change the patterns learned by the networks, and in turn, forces the networks to learn other patterns to make the correct classification. However, the above methods have an important drawback. Randomly dropping features is generally inefficient and can introduce unnecessary noise. To tackle this problem, we propose SelectScale. Instead of randomly dropping units, SelectScale selects the important features in networks and adjusts them during training. Using SelectScale, we improve the performance of CNNs on CIFAR and ImageNet.

preprint2020arXiv

Targeting SARS-CoV-2 with AI- and HPC-enabled Lead Generation: A First Data Release

Researchers across the globe are seeking to rapidly repurpose existing drugs or discover new drugs to counter the the novel coronavirus disease (COVID-19) caused by severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2). One promising approach is to train machine learning (ML) and artificial intelligence (AI) tools to screen large numbers of small molecules. As a contribution to that effort, we are aggregating numerous small molecules from a variety of sources, using high-performance computing (HPC) to computer diverse properties of those molecules, using the computed properties to train ML/AI models, and then using the resulting models for screening. In this first data release, we make available 23 datasets collected from community sources representing over 4.2 B molecules enriched with pre-computed: 1) molecular fingerprints to aid similarity searches, 2) 2D images of molecules to enable exploration and application of image-based deep learning methods, and 3) 2D and 3D molecular descriptors to speed development of machine learning models. This data release encompasses structural information on the 4.2 B molecules and 60 TB of pre-computed data. Future releases will expand the data to include more detailed molecular simulations, computed models, and other products.