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The metabolic network plays a crucial role in regulating bacterial metabolism and growth, but it is subject to inherent molecular stochasticity. Previous studies have utilized flux balance analysis and the maximum entropy method to predict…

Molecular Networks · Quantitative Biology 2024-01-12 Shaohua Guan , Zhichao Zhang , Zihan Zhang , Hualin Shi

Collaborative Business Analysis (CBA) is a methodology that involves bringing together different stakeholders, including business users, analysts, and technical specialists, to collaboratively analyze data and gain insights into business…

Human-Computer Interaction · Computer Science 2023-04-24 Olga Cherednichenko , Fahad Muhammad , Jérôme Darmont , Cécile Favre

Protein dynamics play a crucial role in protein biological functions and properties, and their traditional study typically relies on time-consuming molecular dynamics (MD) simulations conducted in silico. Recent advances in generative…

Biomolecules · Quantitative Biology 2025-06-02 Jiarui Lu , Xiaoyin Chen , Stephen Zhewen Lu , Aurélie Lozano , Vijil Chenthamarakshan , Payel Das , Jian Tang

Many dynamic processes such as telecommunication and transport networks can be described through discrete time series of graphs. Modelling the dynamics of such time series enables prediction of graph structure at future time steps, which…

Machine Learning · Computer Science 2026-02-10 Sevvandi Kandanaarachchi , Ziqi Xu , Stefan Westerlund , Conrad Sanderson

Metabolic fluxes in cells are governed by physical, physiological, and economic principles. Here I assume an optimal allocation of enzyme resources and postulate a general principle for metabolism: each enzyme must convert less valuable…

Molecular Networks · Quantitative Biology 2022-10-06 Wolfram Liebermeister

An automated resource analysis technique is introduced, targeting a Call-By-Push-Value abstract machine, with memory prediction as a practical goal. The machine has a polymorphic and linear type system enhanced with a first-order logical…

Logic in Computer Science · Computer Science 2023-10-24 Hector Suzanne , Emmanuel Chailloux

Organisms have evolved a variety of mechanisms to cope with the unpredictability of environmental conditions, and yet mainstream models of metabolic regulation are typically based on strict optimality principles that do not account for…

Molecular Networks · Quantitative Biology 2020-07-08 David S. Tourigny

An extensive rewiring of cell metabolism supports enhanced proliferation in cancer cells. We propose a systems level approach to describe this phenomenon based on Flux Balance Analysis (FBA). The approach does not explicit a cell biomass…

Computational Engineering, Finance, and Science · Computer Science 2013-10-01 Chiara Damiani , Riccardo Colombo , Sara Molinari , Dario Pescini , Daniela Gaglio , Marco Vanoni , Lilia Alberghina , Giancarlo Mauri

Many recent statistical applications involve inference under complex models, where it is computationally prohibitive to calculate likelihoods but possible to simulate data. Approximate Bayesian Computation (ABC) is devoted to these complex…

Populations and Evolution · Quantitative Biology 2011-06-15 Katalin Csilléry , Olivier François , Michael GB Blum

Dynamic flux balance analysis uses a quasi-steady state assumption to calculate an organism's metabolic activity at each time-step of a dynamic simulation, using the well-known technique of flux balance analysis. For microbial communities,…

Quantitative Methods · Quantitative Biology 2021-01-27 James D. Brunner , Nicholas Chia

We present RKappa, a framework for the development and analysis of rule-based models within a mature, statistically empowered R environment. The infrastructure allows model editing, modification, parameter sampling, simulation, statistical…

Molecular Networks · Quantitative Biology 2014-12-16 Anatoly Sorokin , Oksana Sorokina , J. Douglas Armstrong

Probe-level models have led to improved performance in microarray studies but the various sources of probe-level contamination are still poorly understood. Data-driven analysis of probe performance can be used to quantify the uncertainty in…

Computational Engineering, Finance, and Science · Computer Science 2013-04-09 Leo Lahti , Laura L. Elo , Tero Aittokallio , Samuel Kaski

This article describes lcpy, an open-source python package that allows for advanced parametric Life Cycle Assessment (LCA) and Life Cycle Costing (LCC) analysis. The package is designed to allow the user to model a process with a flexible,…

Emerging Technologies · Computer Science 2025-06-17 Spiros Gkousis , Evina Katsou

We revise the procedure proposed by Balassa to infer comparative advantage, which is a standard tool, in Economics, to analyze specialization (of countries, regions, etc.). Balassa's approach compares the export of a product for each…

Social and Information Networks · Computer Science 2025-02-19 Matteo Bruno , Dario Mazzilli , Aurelio Patelli , Tiziano Squartini , Fabio Saracco

Modern biomedical data mining requires feature selection methods that can (1) be applied to large scale feature spaces (e.g. `omics' data), (2) function in noisy problems, (3) detect complex patterns of association (e.g. gene-gene…

Machine Learning · Computer Science 2018-04-04 Ryan J. Urbanowicz , Randal S. Olson , Peter Schmitt , Melissa Meeker , Jason H. Moore

Estimation by Analogy (EBA) is an increasingly active research method in the area of software engineering. The fundamental assumption of this method is that the similar projects in terms of attribute values will also be similar in terms of…

Software Engineering · Computer Science 2017-03-21 Mohammad Azzeh

This paper introduces the shapr R package, a versatile tool for generating Shapley value-based prediction explanations for machine learning and statistical regression models. Moreover, the shaprpy Python library brings the core capabilities…

Machine Learning · Computer Science 2026-02-03 Martin Jullum , Lars Henry Berge Olsen , Jon Lachmann , Annabelle Redelmeier

Prescriptive Performance Analysis (PPA) has shown to be more useful than traditional descriptive and diagnostic analyses for making sense of Big Data (BD) frameworks' performance. In practice, when processing large (RDF) graphs on top of…

Databases · Computer Science 2022-09-16 Mohamed Ragab , Adam Satria Adidarma , Riccardo Tommasini

Radiology report generation is crucial in medical imaging,but the manual annotation process by physicians is time-consuming and labor-intensive, necessitating the develop-ment of automatic report generation methods. Existingresearch…

Computation and Language · Computer Science 2024-10-25 Yongheng Sun , Yueh Z. Lee , Genevieve A. Woodard , Hongtu Zhu , Chunfeng Lian , Mingxia Liu

The increasing need for causal analysis in large-scale industrial datasets necessitates the development of efficient and scalable causal algorithms for real-world applications. This paper addresses the challenge of scaling causal algorithms…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-01-23 Vishal Verma , Vinod Reddy , Jaiprakash Ravi