Results 51 to 60 of about 669,188 (305)

PREDICTION OF REACTION CONDITIONS BY DEEP LEARNING TECHNIQUES [PDF]

open access: yesНаучно-технический вестник информационных технологий, механики и оптики, 2020
Subject of Research. The paper presents a study of prediction method for various properties of reactions, such as the type of reaction, suitable groups of solvents, catalysts for the reaction.
Vladimir B. Moskalev, Evgeniy O. Putin
doaj  

Missing links as a source of seemingly variable constants in complex reaction networks

open access: yesPhysical Review Research, 2020
A major challenge in network science is to determine parameters governing complex network dynamics from experimental observations and theoretical models.
Zachary G. Nicolaou, Adilson E. Motter
doaj   +1 more source

Asymptotic analysis of multiscale approximations to reaction networks

open access: yes, 2006
A reaction network is a chemical system involving multiple reactions and chemical species. Stochastic models of such networks treat the system as a continuous time Markov chain on the number of molecules of each species with reactions as possible ...
Ball, Karen   +3 more
core   +3 more sources

Reaction Brownian Dynamics and the effect of spatial fluctuations on the gain of a push-pull network [PDF]

open access: yes, 2008
Brownian Dynamics algorithms are widely used for simulating soft-matter and biochemical systems. In recent times, their application has been extended to the simulation of coarse-grained models of cellular networks in simple organisms.
Frenkel D.   +4 more
core   +2 more sources

Atmospheric reaction systems as null-models to identify structural traces of evolution in metabolism. [PDF]

open access: yesPLoS ONE, 2011
The metabolism is the motor behind the biological complexity of an organism. One problem of characterizing its large-scale structure is that it is hard to know what to compare it to. All chemical reaction systems are shaped by the same physics that gives
Petter Holme, Mikael Huss, Sang Hoon Lee
doaj   +1 more source

Stochastic theory of large-scale enzyme-reaction networks: Finite copy number corrections to rate equation models

open access: yes, 2010
Chemical reactions inside cells occur in compartment volumes in the range of atto- to femtolitres. Physiological concentrations realized in such small volumes imply low copy numbers of interacting molecules with the consequence of considerable ...
Alberts B.   +6 more
core   +1 more source

Integration of hydraulic and water quality modelling in distribution networks : EPANET-PMX [PDF]

open access: yes, 2017
Simulation models for water distribution networks are used routinely for many purposes. Some examples are planning, design, monitoring and control. However, under conditions of low pressure, the conventional models that employ demand-driven analysis ...
Seyoum, Alemtsehay G.   +1 more
core   +1 more source

Thermodynamics of random reaction networks. [PDF]

open access: yesPLoS ONE, 2015
Reaction networks are useful for analyzing reaction systems occurring in chemistry, systems biology, or Earth system science. Despite the importance of thermodynamic disequilibrium for many of those systems, the general thermodynamic properties of ...
Jakob Fischer   +2 more
doaj   +1 more source

Chemical reservoir computation in a self-organizing reaction network

open access: yesNature
Chemical reaction networks, such as those found in metabolism and signalling pathways, enable cells to process information from their environment1,2.
Mathieu G Baltussen   +4 more
semanticscholar   +1 more source

Modeling dynamics of chemical reaction networks using electrical analogs: Application to autocatalytic reactions

open access: yesChemical Engineering Journal Advances, 2022
Modeling complex chemical reaction networks has inspired a considerable body of research and a variety of approaches to modeling nonlinear pathways are being developed. Here, a general methodology is formulated to convert an arbitrary reaction network into its equivalent electrical analog.
Sarang S. Nath, John Villadsen
openaire   +3 more sources

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