arXiv subjects

Zhenzhen Xie

Publications and source records attributed to Zhenzhen Xie.

7 recordsLinked to original sources

arXiv2026

DNative-Twin: Decision Graphs and Digital Twins for Reconstructable Agentic Decisions

AI agents increasingly gather evidence, invoke tools, apply constraints, and produce decisions that people or software may commit to action. A final output alone cannot show which evidence, tool state, rule, authorization, or action path produced it. We present DNative-Twin, a graph-native digital twin that records a committed agentic decision as a typed trajectory and re-executes its decision mechanism under declared conditions. The graph links the state observed by the agent, the path it followed, and the authority behind the resulting action. The twin synchronizes this information, replays the mechanism in isolation, and compares it under controlled changes. We instantiate the framework in enterprise decision processes using three public process logs and controlled replay suites. The experiments identify a specific failure: graph structure localizes represented changes but cannot determine the consequence of an unobserved tool state. In a three-condition controlled experiment with 300 injected instances, unresolved-divergence recall increased from 0 to 0.667 when replay-contract state was added and to 1.0 when verification results were also available; the held-out set contained no critical-class instance. Across 500--5,000 BPI 2020 cases, median end-to-end time increased from 0.794 to 8.889 seconds on the reported platform. These results separate the roles of graph structure, replay context, and verification evidence in reviewing a decision mechanism.

cs.AI↗

arXiv2025

MCP-Guard: A Multi-Stage Defense-in-Depth Framework for Securing Model Context Protocol in Agentic AI

While Large Language Models (LLMs) have achieved remarkable performance, they remain vulnerable to jailbreak. The integration of Large Language Models (LLMs) with external tools via protocols such as the Model Context Protocol (MCP) introduces critical security vulnerabilities, including prompt injection, data exfiltration, and other threats. To counter these challenges, we propose MCP-GUARD, a robust, layered defense architecture designed for LLM-tool interactions. MCP-GUARD employs a three-stage detection pipeline that balances efficiency with accuracy: it progresses from lightweight static scanning for overt threats and a deep neural detector for semantic attacks, to our fine-tuned E5-based model which achieves 96.01\% accuracy in identifying adversarial prompts. Finally, an LLM arbitrator synthesizes these signals to deliver the final decision. To enable rigorous training and evaluation, we introduce MCP-ATTACKBENCH, a comprehensive benchmark comprising 70,448 samples augmented by GPT-4. This benchmark simulates diverse real-world attack vectors that circumvent conventional defenses in the MCP paradigm, thereby laying a solid foundation for future research on securing LLM-tool ecosystems.

cs.CR↗

arXiv2025

Artificial intelligence in drug discovery: A comprehensive review with a case study on hyperuricemia, gout arthritis, and hyperuricemic nephropathy

This paper systematically reviews recent advances in artificial intelligence (AI), with a particular focus on machine learning (ML), across the entire drug discovery pipeline. Due to the inherent complexity, escalating costs, prolonged timelines, and high failure rates of traditional drug discovery methods, there is a critical need to comprehensively understand how AI/ML can be effectively integrated throughout the full process. Currently available literature reviews often narrowly focus on specific phases or methodologies, neglecting the dependence between key stages such as target identification, hit screening, and lead optimization. To bridge this gap, our review provides a detailed and holistic analysis of AI/ML applications across these core phases, highlighting significant methodological advances and their impacts at each stage. We further illustrate the practical impact of these techniques through an in-depth case study focused on hyperuricemia, gout arthritis, and hyperuricemic nephropathy, highlighting real-world successes in molecular target identification and therapeutic candidate discovery. Additionally, we discuss significant challenges facing AI/ML in drug discovery and outline promising future research directions. Ultimately, this review serves as an essential orientation for researchers aiming to leverage AI/ML to overcome existing bottlenecks and accelerate drug discovery.

cs.AI↗

arXiv2024

A Resource-Adaptive Approach for Federated Learning under Resource-Constrained Environments

The paper studies a fundamental federated learning (FL) problem involving multiple clients with heterogeneous constrained resources. Compared with the numerous training parameters, the computing and communication resources of clients are insufficient for fast local training and real-time knowledge sharing. Besides, training on clients with heterogeneous resources may result in the straggler problem. To address these issues, we propose Fed-RAA: a Resource-Adaptive Asynchronous Federated learning algorithm. Different from vanilla FL methods, where all parameters are trained by each participating client regardless of resource diversity, Fed-RAA adaptively allocates fragments of the global model to clients based on their computing and communication capabilities. Each client then individually trains its assigned model fragment and asynchronously uploads the updated result. Theoretical analysis confirms the convergence of our approach. Additionally, we design an online greedy-based algorithm for fragment allocation in Fed-RAA, achieving fairness comparable to an offline strategy. We present numerical results on MNIST, CIFAR-10, and CIFAR-100, along with necessary comparisons and ablation studies, demonstrating the advantages of our work. To the best of our knowledge, this paper represents the first resource-adaptive asynchronous method for fragment-based FL with guaranteed theoretical convergence.

cs.LG↗

arXiv2024

HyperFedNet: Communication-Efficient Personalized Federated Learning Via Hypernetwork

In response to the challenges posed by non-independent and identically distributed (non-IID) data and the escalating threat of privacy attacks in Federated Learning (FL), we introduce HyperFedNet (HFN), a novel architecture that incorporates hypernetworks to revolutionize parameter aggregation and transmission in FL. Traditional FL approaches, characterized by the transmission of extensive parameters, not only incur significant communication overhead but also present vulnerabilities to privacy breaches through gradient analysis. HFN addresses these issues by transmitting a concise set of hypernetwork parameters, thereby reducing communication costs and enhancing privacy protection. Upon deployment, the HFN algorithm enables the dynamic generation of parameters for the basic layer of the FL main network, utilizing local database features quantified by embedding vectors as input. Through extensive experimentation, HFN demonstrates superior performance in reducing communication overhead and improving model accuracy compared to conventional FL methods. By integrating the HFN algorithm into the FL framework, HFN offers a solution to the challenges of non-IID data and privacy threats.

cs.NI↗

arXiv2021

Inverse currents in Coulomb-coupled quantum dots

The inverse current, i.e., induced current is opposite to applied force, has recentlybeen found in a classical one-dimensional interacting Hamiltonian system [Phys. Rev.Lett. 124, 110607 (2020)]. In this paper, we show that inverse current also exists in quantum system. Based on Coulomb-coupled quantum dots system, we find that inverse current will appear when Coulomb interaction increases. This does not violate the second law of thermodynamics, since entropy reduction caused by inverse current is compensated by entropy increase caused by forward current, which ensure that total entropy increase of the system is always greater than zero.

quant-ph↗

arXiv2020

Collaborative City Digital Twin For Covid-19 Pandemic: A Federated Learning Solution

In this work, we propose a collaborative city digital twin based on FL, a novel paradigm that allowing multiple city DT to share the local strategy and status in a timely manner. In particular, an FL central server manages the local updates of multiple collaborators (city DT), provides a global model which is trained in multiple iterations at different city DT systems, until the model gains the correlations between various response plan and infection trend. That means, a collaborative city DT paradigm based on FL techniques can obtain knowledge and patterns from multiple DTs, and eventually establish a `global view' for city crisis management. Meanwhile, it also helps to improve each city digital twin selves by consolidating other DT's respective data without violating privacy rules. To validate the proposed solution, we take COVID-19 pandemic as a case study. The experimental results on the real dataset with various response plan validate our proposed solution and demonstrate the superior performance.

cs.LG↗