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Xiang-Yang Li

Publications and source records attributed to Xiang-Yang Li.

At least 37 records · Page 2Linked to original sources

MolChord: Structure-Sequence Alignment for Protein-Guided Drug Design

Structure-based drug design (SBDD), which maps target proteins to candidate molecular ligands, is a fundamental task in drug discovery. Effectively aligning protein structural representations with molecular representations, and ensuring alignment between generated drugs and their pharmacological properties, remains a critical challenge. To address these challenges, we propose MolChord, which integrates two key techniques: (1) to align protein and molecule structures with their textual descriptions and sequential representations (e.g., FASTA for proteins and SMILES for molecules), we leverage NatureLM, an autoregressive model unifying text, small molecules, and proteins, as the molecule generator, alongside a diffusion-based structure encoder; and (2) to guide molecules toward desired properties, we curate a property-aware dataset by integrating preference data and refine the alignment process using Direct Preference Optimization (DPO). Experimental results on CrossDocked2020 demonstrate that our approach achieves state-of-the-art performance on key evaluation metrics, highlighting its potential as a practical tool for SBDD.

cs.AI↗

Distributed quantum algorithm for divergence estimation and beyond

With the rapid advancement of quantum information technology, designing efficient distributed quantum algorithms to perform various information processing tasks remains challenging. In this paper, we consider a distributed scenario where two parties, Alice and Bob, given access to matrices $A$ and $B$ respectively, aim to estimate ${\rm Tr}(f(A)g(B))$, where $f$ and $g$ are known functions. In this task, only local quantum operations, classical communication and single-qubit measurements are allowed due to the high cost of quantum communication and entangled measurements. We propose a distributed quantum algorithm framework to compute ${\rm Tr}(f(A)g(B))$ within an additive error $\varepsilon$. The proposed algorithm framework requires $\widetilde{O}\left(d^2 / (δ\varepsilon^2)\right)$ quantum queries and two-qubit gates, assuming that the minimum singular value of each matrix $A, B \in \mathbb{C}^{d \times d}$ is at least $δ$. Additionally, our algorithm framework uses a simple Hadamard test architecture, enabling easier quantum hardware implementation. This algorithm framework allows for various applications including quantum divergence estimation, distributed solving of linear system, and distributed Hamiltonian simulation, while preserving the privacy of both parties. Furthermore, we establish a lower bound of $Ω\left(\max\left\{1 /\varepsilon^2, \sqrt{dr}/\varepsilon\right\}\right)$ on the query complexity for the task, where $r$ denotes the rank of the input matrices. We believe this framework holds broad applicability across a range of distributed quantum computing tasks.

quant-ph↗

AttenTrack: Mobile User Attention Awareness Based on Context and External Distractions

In the mobile internet era, managing limited attention amid information overload is crucial for enhancing collaboration and information delivery. However, current attention-aware systems often depend on wearables or personalized data, limiting their scalability and cross-context adaptability. Inspired by psychological theories, we attempt to treat mobile notifications as naturally occurring external distractions and infer users' attention states based on their response behaviors and contextual information. Our goal is to build an attention-aware model that does not rely on personalized historical data or complex subjective input, while ensuring strong cold-start capability and cross-context adaptability. To this end, We design a field study framework integrating subjective and objective data, closely aligned with real-world external distractions (i.e., mobile notifications). Through field studies, we construct a fine-grained and interpretable dataset centered on the relationship among current context - external distractions - subjective attention. Through our field studies, we conduct an in-depth analysis of the relationships among users' response behaviors, response motivations, contextual information, and attention states. Building on our findings, we propose AttenTrack, a lightweight, privacy-friendly attention awareness model with strong cold-start capability. The model relies solely on non-privacy-sensitive objective data available on mobile devices, and can be applied to a variety of attention management tasks. In addition, we will publicly release the constructed dataset to support future research and advance the field of mobile attention awareness.

cs.HC↗

SECNEURON: Reliable and Flexible Abuse Control in Local LLMs via Hybrid Neuron Encryption

Large language models (LLMs) with diverse capabilities are increasingly being deployed in local environments, presenting significant security and controllability challenges. These locally deployed LLMs operate outside the direct control of developers, rendering them more susceptible to abuse. Existing mitigation techniques mainly designed for cloud-based LLM services are frequently circumvented or ineffective in deployer-controlled environments. We propose SECNEURON, the first framework that seamlessly embeds classic access control within the intrinsic capabilities of LLMs, achieving reliable, cost-effective, flexible, and certified abuse control for local deployed LLMs. SECNEURON employs neuron-level encryption and selective decryption to dynamically control the task-specific capabilities of LLMs, limiting unauthorized task abuse without compromising others. We first design a task-specific neuron extraction mechanism to decouple logically related neurons and construct a layered policy tree for handling coupled neurons. We then introduce a flexible and efficient hybrid encryption framework for millions of neurons in LLMs. Finally, we developed a distribution-based decrypted neuron detection mechanism on ciphertext to ensure the effectiveness of partially decrypted LLMs. We proved that SECNEURON satisfies IND-CPA Security and Collusion Resistance Security under the Task Controllability Principle. Experiments on various task settings show that SECNEURON limits unauthorized task accuracy to below 25% while keeping authorized accuracy loss with 2%. Using an unauthorized Code task example, the accuracy of abuse-related malicious code generation was reduced from 59% to 15%. SECNEURON also mitigates unauthorized data leakage, reducing PII extraction rates to below 5% and membership inference to random guesses.

cs.CR↗

RINN: One Sample Radio Frequency Imaging based on Physics Informed Neural Network

Due to its ability to work in non-line-of-sight and low-light environments, radio frequency (RF) imaging technology is expected to bring new possibilities for embodied intelligence and multimodal sensing. However, widely used RF devices (such as Wi-Fi) often struggle to provide high-precision electromagnetic measurements and large-scale datasets, hindering the application of RF imaging technology. In this paper, we combine the ideas of PINN to design the RINN network, using physical constraints instead of true value comparison constraints and adapting it with the characteristics of ubiquitous RF signals, allowing the RINN network to achieve RF imaging using only one sample without phase and with amplitude noise. Our numerical evaluation results show that compared with 5 classic algorithms based on phase data for imaging results, RINN's imaging results based on phaseless data are good, with indicators such as RRMSE (0.11) performing similarly well. RINN provides new possibilities for the universal development of radio frequency imaging technology.

eess.IV↗

Measuring Discrete Sensing Capability for ISAC via Task Mutual Information

6G technology offers a broader range of possibilities for communication systems to perform ubiquitous sensing tasks, including health monitoring, object recognition, and autonomous driving. Since even minor environmental changes can significantly degrade system performance, and conducting long-term posterior experimental evaluations in all scenarios is often infeasible, it is crucial to perform a priori performance assessments to design robust and reliable systems. In this paper, we consider a discrete ubiquitous sensing system where the sensing target has \(m\) different states \(W\), which can be characterized by \(n\)-dimensional independent features \(X^n\). This model not only provides the possibility of optimizing the sensing systems at a finer granularity and balancing communication and sensing resources, but also provides theoretical explanations for classical intuitive feelings (like more modalities and more accuracy) in wireless sensing. Furthermore, we validate the effectiveness of the proposed channel model through real-case studies, including person identification, displacement detection, direction estimation, and device recognition. The evaluation results indicate a Pearson correlation coefficient exceeding 0.9 between our task mutual information and conventional experimental metrics (e.g., accuracy). The open source address of the code is: https://github.com/zaoanhh/DTMI

cs.IT↗

CLCR: Contrastive Learning-based Constraint Reordering for Efficient MILP Solving

Constraint ordering plays a critical role in the efficiency of Mixed-Integer Linear Programming (MILP) solvers, particularly for large-scale problems where poorly ordered constraints trigger increased LP iterations and suboptimal search trajectories. This paper introduces CLCR (Contrastive Learning-based Constraint Reordering), a novel framework that systematically optimizes constraint ordering to accelerate MILP solving. CLCR first clusters constraints based on their structural patterns and then employs contrastive learning with a pointer network to optimize their sequence, preserving problem equivalence while improving solver efficiency. Experiments on benchmarks show CLCR reduces solving time by 30% and LP iterations by 25% on average, without sacrificing solution accuracy. This work demonstrates the potential of data-driven constraint ordering to enhance optimization models, offering a new paradigm for bridging mathematical programming with machine learning.

cs.LG↗

Beyond Local Selection: Global Cut Selection for Enhanced Mixed-Integer Programming

In mixed-integer programming (MIP) solvers, cutting planes are essential for Branch-and-Cut (B&C) algorithms as they reduce the search space and accelerate the solving process. Traditional methods rely on hard-coded heuristics for cut plane selection but fail to leverage problem-specific structural features. Recent machine learning approaches use neural networks for cut selection but focus narrowly on the efficiency of single-node within the B&C algorithm, without considering the broader contextual information. To address this, we propose Global Cut Selection (GCS), which uses a bipartite graph to represent the search tree and combines graph neural networks with reinforcement learning to develop cut selection strategies. Unlike prior methods, GCS applies cutting planes across all nodes, incorporating richer contextual information. Experiments show GCS significantly improves solving efficiency for synthetic and large-scale real-world MIPs compared to traditional and learning-based methods.

cs.AI↗

PICE: A Semantic-Driven Progressive Inference System for LLM Serving in Cloud-Edge Networks

Large language models (LLMs), while driving a new wave of interactive AI applications across numerous domains, suffer from high inference costs and heavy cloud dependency. Motivated by the redundancy phenomenon in linguistics, we propose a progressive inference paradigm over cloud and edge, i.e., firstly generating the sketch of the answer by LLMs at cloud, and then conducting parallel extension to fill in details by small models (SLMs) at edge. Progressive inference offers potential benefits to improve throughput and reduce inference latency while facing key implementation challenges, including decreased response quality from SLMs, a tradeoff between the brevity and comprehensiveness of sketches, as well as increased latency caused by network transmission and edge inference. In this work, we propose and implement PICE, an LLM serving system with semantic-level cloud-edge collaboration, enhancing inference throughput and quality through dynamic inference task scheduling, ensemble learning, and parallel edge inference. Extensive testbed experiments illustrate that our approach achieves $1.5-2\times$ throughput enhancement and up to 43% latency reduction, while also potentially enhancing the quality compared to SOTA systems.

cs.DC↗

Real-Time Neural-Enhancement for Online Cloud Gaming

Online Cloud gaming demands real-time, high-quality video transmission across variable wide-area networks (WANs). Neural-enhanced video transmission algorithms employing super-resolution (SR) for video quality enhancement have effectively challenged WAN environments. However, these SR-based methods require intensive fine-tuning for the whole video, making it infeasible in diverse online cloud gaming. To address this, we introduce River, a cloud gaming delivery framework designed based on the observation that video segment features in cloud gaming are typically repetitive and redundant. This permits a significant opportunity to reuse fine-tuned SR models, reducing the fine-tuning latency of minutes to query latency of milliseconds. To enable the idea, we design a practical system that addresses several challenges, such as model organization, online model scheduler, and transfer strategy. River first builds a content-aware encoder that fine-tunes SR models for diverse video segments and stores them in a lookup table. When delivering cloud gaming video streams online, River checks the video features and retrieves the most relevant SR models to enhance the frame quality. Meanwhile, if no existing SR model performs well enough for some video segments, River will further fine-tune new models and update the lookup table. Finally, to avoid the overhead of streaming model weight to the clients, River designs a prefetching strategy that predicts the models with the highest possibility of being retrieved. Our evaluation based on real video game streaming demonstrates River can reduce redundant training overhead by 44% and improve the Peak-Signal-to-Noise-Ratio by 1.81dB compared to the SOTA solutions. Practical deployment shows River meets real-time requirements, achieving approximately 720p 20fps on mobile devices.

cs.NI↗

FFCG: Effective and Fast Family Column Generation for Solving Large-Scale Linear Program

Column Generation (CG) is an effective and iterative algorithm to solve large-scale linear programs (LP). During each CG iteration, new columns are added to improve the solution of the LP. Typically, CG greedily selects one column with the most negative reduced cost, which can be improved by adding more columns at once. However, selecting all columns with negative reduced costs would lead to the addition of redundant columns that do not improve the objective value. Therefore, selecting the appropriate columns to add is still an open problem and previous machine-learning-based approaches for CG only add a constant quantity of columns per iteration due to the state-space explosion problem. To address this, we propose Fast Family Column Generation (FFCG) -- a novel reinforcement-learning-based CG that selects a variable number of columns as needed in an iteration. Specifically, we formulate the column selection problem in CG as an MDP and design a reward metric that balances both the convergence speed and the number of redundant columns. In our experiments, FFCG converges faster on the common benchmarks and reduces the number of CG iterations by 77.1% for Cutting Stock Problem (CSP) and 84.8% for Vehicle Routing Problem with Time Windows (VRPTW), and a 71.4% reduction in computing time for CSP and 84.0% for VRPTW on average compared to several state-of-the-art baselines.

cs.LG↗

The Field-based Model: A New Perspective on RF-based Material Sensing

This paper introduces the design and implementation of WiField, a WiFi sensing system deployed on COTS devices that can simultaneously identify multiple wavelength-level targets placed flexibly. Unlike traditional RF sensing schemes that focus on specific targets and RF links, WiField focuses on all media in the sensing area for the entire electric field. In this perspective, WiField provides a unified framework to finely characterize the diffraction, scattering, and other effects of targets at different positions, materials, and numbers on signals. The combination of targets in different positions, numbers, and sizes is just a special case. WiField proposed a scheme that utilizes phaseless data to complete the inverse mapping from electric field to material distribution, thereby achieving the simultaneous identification of multiple wavelength-level targets at any position and having the potential for deployment on a wide range of low-cost COTS devices. Our evaluation results show that it has an average identification accuracy of over 97% for 1-3 targets (5 cm * 10 cm in size) with different materials randomly placed within a 1.05 m * 1.05 m area.

eess.SP↗

DeepCore: Simple Fingerprint Construction for Differentiating Homologous and Piracy Models

As intellectual property rights, the copyright protection of deep models is becoming increasingly important. Existing work has made many attempts at model watermarking and fingerprinting, but they have ignored homologous models trained with similar structures or training datasets. We highlight challenges in efficiently querying black-box piracy models to protect model copyrights without misidentifying homologous models. To address these challenges, we propose a novel method called DeepCore, which discovers that the classification confidence of the model is positively correlated with the distance of the predicted sample from the model decision boundary and piracy models behave more similarly at high-confidence classified sample points. Then DeepCore constructs core points far away from the decision boundary by optimizing the predicted confidence of a few sample points and leverages behavioral discrepancies between piracy and homologous models to identify piracy models. Finally, we design different model identification methods, including two similarity-based methods and a clustering-based method to identify piracy models using models' predictions of core points. Extensive experiments show the effectiveness of DeepCore in identifying various piracy models, achieving lower missed and false identification rates, and outperforming state-of-the-art methods.

cs.CR↗

ViRED: Prediction of Visual Relations in Engineering Drawings

To accurately understand engineering drawings, it is essential to establish the correspondence between images and their description tables within the drawings. Existing document understanding methods predominantly focus on text as the main modality, which is not suitable for documents containing substantial image information. In the field of visual relation detection, the structure of the task inherently limits its capacity to assess relationships among all entity pairs in the drawings. To address this issue, we propose a vision-based relation detection model, named ViRED, to identify the associations between tables and circuits in electrical engineering drawings. Our model mainly consists of three parts: a vision encoder, an object encoder, and a relation decoder. We implement ViRED using PyTorch to evaluate its performance. To validate the efficacy of ViRED, we conduct a series of experiments. The experimental results indicate that, within the engineering drawing dataset, our approach attained an accuracy of 96\% in the task of relation prediction, marking a substantial improvement over existing methodologies. The results also show that ViRED can inference at a fast speed even when there are numerous objects in a single engineering drawing.

cs.CV↗

SGSM: A Foundation-model-like Semi-generalist Sensing Model

The significance of intelligent sensing systems is growing in the realm of smart services. These systems extract relevant signal features and generate informative representations for particular tasks. However, building the feature extraction component for such systems requires extensive domain-specific expertise or data. The exceptionally rapid development of foundation models is likely to usher in newfound abilities in such intelligent sensing. We propose a new scheme for sensing model, which we refer to as semi-generalist sensing model (SGSM). SGSM is able to semiautomatically solve various tasks using relatively less task-specific labeled data compared to traditional systems. Built through the analysis of the common theoretical model, SGSM can depict different modalities, such as the acoustic and Wi-Fi signal. Experimental results on such two heterogeneous sensors illustrate that SGSM functions across a wide range of scenarios, thereby establishing its broad applicability. In some cases, SGSM even achieves better performance than sensor-specific specialized solutions. Wi-Fi evaluations indicate a 20\% accuracy improvement when applying SGSM to an existing sensing model.

eess.SP↗

Secure Transformer Inference Protocol

Security of model parameters and user data is critical for Transformer-based services, such as ChatGPT. While recent strides in secure two-party protocols have successfully addressed security concerns in serving Transformer models, their adoption is practically infeasible due to the prohibitive cryptographic overheads involved. Drawing insights from our hands-on experience in developing two real-world Transformer-based services, we identify the inherent efficiency bottleneck in the two-party assumption. To overcome this limitation, we propose a novel three-party threat model. Within this framework, we design a semi-symmetric permutation-based protection scheme and present STIP, the first secure Transformer inference protocol without any inference accuracy loss. Experiments on representative Transformer models in real systems show that STIP has practical security and outperforms state-of-the-art secure two-party protocols in efficiency by millions of times.

cs.CR↗

NaturalSpeech 3: Zero-Shot Speech Synthesis with Factorized Codec and Diffusion Models

While recent large-scale text-to-speech (TTS) models have achieved significant progress, they still fall short in speech quality, similarity, and prosody. Considering speech intricately encompasses various attributes (e.g., content, prosody, timbre, and acoustic details) that pose significant challenges for generation, a natural idea is to factorize speech into individual subspaces representing different attributes and generate them individually. Motivated by it, we propose NaturalSpeech 3, a TTS system with novel factorized diffusion models to generate natural speech in a zero-shot way. Specifically, 1) we design a neural codec with factorized vector quantization (FVQ) to disentangle speech waveform into subspaces of content, prosody, timbre, and acoustic details; 2) we propose a factorized diffusion model to generate attributes in each subspace following its corresponding prompt. With this factorization design, NaturalSpeech 3 can effectively and efficiently model intricate speech with disentangled subspaces in a divide-and-conquer way. Experiments show that NaturalSpeech 3 outperforms the state-of-the-art TTS systems on quality, similarity, prosody, and intelligibility, and achieves on-par quality with human recordings. Furthermore, we achieve better performance by scaling to 1B parameters and 200K hours of training data.

eess.AS↗

Ecmas: Efficient Circuit Mapping and Scheduling for Surface Code

As the leading candidate of quantum error correction codes, surface code suffers from significant overhead, such as execution time. Reducing the circuit's execution time not only enhances its execution efficiency but also improves fidelity. However, finding the shortest execution time is NP-hard. In this work, we study the surface code mapping and scheduling problem. To reduce the execution time of a quantum circuit, we first introduce two novel metrics: Circuit Parallelism Degree and Chip Communication Capacity to quantitatively characterize quantum circuits and chips. Then, we propose a resource-adaptive mapping and scheduling method, named Ecmas, with customized initialization of chip resources for each circuit. Ecmas can dramatically reduce the execution time in both double defect and lattice surgery models. Furthermore, we provide an additional version Ecmas-ReSu for sufficient qubits, which is performance-guaranteed and more efficient. Extensive numerical tests on practical datasets show that Ecmas outperforms the state-of-the-art methods by reducing the execution time by 51.5% on average for double defect model. Ecmas can reach the optimal result in most benchmarks, reducing the execution time by up to 13.9% for lattice surgery model.

quant-ph↗