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In the field of modeling, the word validation refers to simple comparisons between model outputs and experimental data. Usually, this comparison constitutes plotting the model results against data on the same axes to provide a visual…

应用统计 · 统计学 2021-06-11 Farid Mohammadi

Biological organisms are composed of numerous interconnected biochemical processes. Diseases occur when normal functionality of these processes is disrupted. Thus, understanding these biochemical processes and their interrelationships is a…

人工智能 · 计算机科学 2014-03-04 Saadat Anwar

The case study analyzed in the report involves the behavioral specification and verification of a three-stage pipeline consisting of mutually concurrent modules which also compete for a shared resource. The system components are specified…

软件工程 · 计算机科学 2017-05-16 Jerzy Mieścicki , Bogdan Czejdo , Wiktor B. Daszczuk

Classifying chemicals according to putative modes of action (MOAs) is of paramount importance in the context of risk assessment. However, current methods are only able to handle a very small proportion of the existing chemicals. We address…

定量方法 · 定量生物学 2018-11-28 Cătălina Cangea , Arturas Grauslys , Pietro Liò , Francesco Falciani

Systems design processes are increasingly reliant on simulation models to inform design decisions. A pervasive issue within the systems engineering community is trusting in the models used to make decisions about complex systems. This work…

计算工程、金融与科学 · 计算机科学 2025-08-05 Edward Louis , Gregory Mocko , Evan Taylor

Polynomial dynamical systems are widely used to model and study real phenomena. In biochemistry, they are the preferred choice for modelling the concentration of chemical species in reaction networks with mass-action kinetics. These systems…

代数几何 · 数学 2014-12-30 Elisenda Feliu

An engineering design process may involve software modules that can executed concurrently. Concurrent modules can be very easily subject to some synchronization errors. This paper discusses verification process for such engineering…

软件工程 · 计算机科学 2017-04-24 Jerzy Mieścicki , Mikołaj Baszun , Wiktor B. Daszczuk , Bogdan D. Czejdo

Models of physical systems are used to explain and predict experimental results and observations. When students encounter discrepancies between the actual and expected behavior of a system, they revise their models to include the newly…

物理教育 · 物理学 2022-07-06 Laura Ríos , Benjamin Pollard , Dimitri R. Dounas-Frazer , H. J. Lewandowski

Classical supervised learning evaluates models primarily via predictive risk on hold-out data. Such evaluations quantify how well a function behaves on a distribution, but they do not address whether the internal decomposition of a model is…

机器学习 · 计算机科学 2025-12-08 Suman Sanyal

The growing complexity of factual claims in real-world scenarios presents significant challenges for automated fact verification systems, particularly in accurately aggregating and reasoning over multi-hop evidence. Existing approaches…

人工智能 · 计算机科学 2025-06-10 Liwen Zheng , Chaozhuo Li , Haoran Jia , Xi Zhang

The safety of automated driving systems must be justified by convincing arguments and supported by compelling evidence to persuade certification agencies, regulatory entities, and the general public to allow the systems on public roads.…

软件工程 · 计算机科学 2024-10-28 Jonas Krook , Yuvaraj Selvaraj , Wolfgang Ahrendt , Martin Fabian

Machine learning models in safety-critical settings like healthcare are often blackboxes: they contain a large number of parameters which are not transparent to users. Post-hoc explainability methods where a simple, human-interpretable…

机器学习 · 计算机科学 2022-06-03 Aparna Balagopalan , Haoran Zhang , Kimia Hamidieh , Thomas Hartvigsen , Frank Rudzicz , Marzyeh Ghassemi

In this paper, we present a modelling experiment developed to study systems of cities and processes of urbanisation in large territories over long time spans. Building on geographical theories of urban evolution, we rely on agent-based…

Molecular property prediction is a crucial task that guides the design of new compounds, including drugs and materials. While explainable artificial intelligence methods aim to scrutinize model predictions by identifying influential…

机器学习 · 计算机科学 2025-08-27 Łukasz Janisiów , Marek Kochańczyk , Bartosz Zieliński , Tomasz Danel

We show that very simple molecular systems, modeled as chemical reaction networks, can have behaviors that exhibit dramatic phase transitions at certain population thresholds. Moreover, the magnitudes of these thresholds can thwart attempts…

新兴技术 · 计算机科学 2020-06-02 James I. Lathrop , Jack H. Lutz , Robyn R. Lutz , Hugh D. Potter , Matthew R. Riley

Robustness of biochemical systems has become one of the central questions in systems biology although it is notoriously difficult to formally capture its multifaceted nature. Maintenance of normal system function depends not only on the…

分子网络 · 定量生物学 2012-03-28 Jost Neigenfind , Sergio Grimbs , Zoran Nikoloski

Disentangling the mechanistic details of a chemical reaction pathway is a hard problem that often requires a considerable amount of chemical intuition and a component of luck. Experiments struggle in observing short-life metastable…

化学物理 · 物理学 2019-08-01 Valerio Rizzi , Dan Mendels , Emilia Sicilia , Michele Parrinello

In this paper, we present VerifyML, the first secure inference framework to check the fairness degree of a given Machine learning (ML) model. VerifyML is generic and is immune to any obstruction by the malicious model holder during the…

密码学与安全 · 计算机科学 2022-10-18 Guowen Xu , Xingshuo Han , Gelei Deng , Tianwei Zhang , Shengmin Xu , Jianting Ning , Anjia Yang , Hongwei Li

When verifying liveness properties on a transition system, it is often necessary to discard spurious violating paths by making assumptions on which paths represent realistic executions. Capturing that some property holds under such an…

计算机科学中的逻辑 · 计算机科学 2024-07-12 Myrthe Spronck , Bas Luttik , Tim Willemse