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Stochastic Simulations in Systems Biology

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In-core dosimetry for the validation of neutron spectra in the CROCUS reactor

Andreas Pautz, Vincent Pierre Lamirand, Pavel Frajtag, Axel Guy Marie Laureau, Yifeng Jiang

The present article describes the preliminary validation study of simulated in-core and reflector n eutron spectra in preparation of oncoming experimental programs in the zero-power reactor CROCUS at EPFL. For this purpose, a set of activation foils were i ...

E D P SCIENCES2020

Iterative distributed fault detection and isolation for linear systems based on moving horizon estimation

René Uwe Schneider, Marcello Farina

In modern engineering systems, reliability and safety can be conferred by efficient automatic monitoring and fault detection algorithms, allowing for the early identification and isolation of incipient faults. In case of large-scale and complex systems, sc ...

2020

As demands for computing have been continuously increasing, various solutions have been proposed. Some approaches deal with improving algorithms and software programs, mainly through the tuning of advanced heuristics and learning methods. Some other tackle ...

2020

To understand water quality degradation during hypoxia, we need to understand sediment oxygen ﬂuxes, the main oxygen sink in shallow hypolimnia. Kinetic models, which integrate diﬀusion and consumption of dissolved oxygen (DO) in sediments, usually assume ...

2020

Motility-Induced Microphase and Macrophase Separation in a Two-Dimensional Active Brownian Particle System

Pasquale Digregorio

As a result of nonequilibrium forces, purely repulsive self-propelled particles undergo macrophase separation between a dense and a dilute phase. We present a thorough study of the ordering kinetics of such motility-induced phase separation (MIPS) in activ ...

2020

Micropollutant Oxidation Studied by Quantum Chemical Computations: Methodology and Applications to Thermodynamics, Kinetics, and Reaction Mechanisms

Urs von Gunten, Minju Lee, Peter Rudolf Tentscher

The abatement of organic micropollutants during oxidation processes has become an emerging issue for various urban water systems such as drinking water, wastewater, and water reuse. Reaction kinetics and mechanisms play an important role in terms of effici ...

AMER CHEMICAL SOC2019

Shewanella oneidensis produces an extensive electron transfer network that results in metabolic flexibility. A large number of c-type cytochromes are expressed by S. oneidensis and these function as the fundamental electron transport chain proteins. Althou ...

2018

Global Identification of Kinetic Parameters via the Extent-based Incremental Approach

Dominique Bonvin, Julien Léo Billeter, Diogo Filipe Mateus Rodrigues

The identification of reaction kinetics represents the main challenge in building models for reaction systems. The identification task can be performed via either simultaneous model identification (SMI) or incremental model identification (IMI), the latter ...

2017

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2017

Incremental Kinetic Modeling of Spectroscopic Data using a Reduced Calibration Model

Dominique Bonvin, Julien Léo Billeter

The identification of kinetic models is an important step for the monitoring, control and optimization of chemical processes. Kinetic models are often based on first principles that describe the evolution of concentrations by means of conservation and cons ...

2017