Real-time optimization and control of nonlinear processes using machine learning

Z Zhang, Z Wu, D Rincon, PD Christofides - Mathematics, 2019 - mdpi.com
Machine learning has attracted extensive interest in the process engineering field, due to the
capability of modeling complex nonlinear process behavior. This work presents a method for …

Application of neural networks in structure–activity relationships

I Kövesdi, MF Dominguez‐Rodriguez… - Medicinal research …, 1999 - Wiley Online Library
Methodology and application of artificial neural networks in structure–activity relationships
are reviewed focusing on the most frequently used three‐layer feedforward back …

Benchmarking chemical neural ordinary differential equations to obtain reaction network-constrained kinetic models from spectroscopic data

A Puliyanda, K Srinivasan, Z Li, V Prasad - Engineering Applications of …, 2023 - Elsevier
Kinetic model identification relies on accurate concentration measurements and physical
constraints to limit solution multiplicity. Not having these measurements and prior knowledge …

[HTML][HTML] Direct coupling of microkinetic and reactor models using neural networks

B Klumpers, T Luijten, S Gerritse, E Hensen… - Chemical Engineering …, 2023 - Elsevier
Microkinetic modelling facilitates a detailed description of chemical reactions and has been
an important tool in heterogeneous catalysis research to resolve mechanisms at the …

A study originated from combination of electrochemistry and chemometrics for investigation of the inhibitory effects of ciprofloxacin as a potent inhibitor on cytochrome …

AR Jalalvand - Microchemical Journal, 2020 - Elsevier
In this paper, we are going to report results of a study which has been performed to
investigate inhibition of cytochrome P450 (CYP) by ciprofloxacin (CIF) in which …

Neural network approach to support modelling of chemical reactors: problems, resolutions, criteria of application

EJ Molga - Chemical Engineering and Processing: Process …, 2003 - Elsevier
New aspects of neural modelling of chemical reactors have been investigated in this study.
An universal method to create a family of neural models, useful for the reactor and reacting …

PSO–ANN-based prediction of cobalt leaching rate from waste lithium-ion batteries

H Ebrahimzade, GR Khayati, M Schaffie - Journal of Material Cycles and …, 2019 - Springer
Leaching is a complex solid–liquid reaction which has an important influence on the
recovery efficiency of the spent lithium-ion batteries (LIBs). Therefore, it is of significant …

Hybrid artificial neural network—First principle model formulation for the unsteady state simulation and analysis of a packed bed reactor for CO2 hydrogenation to …

G Zahedi, A Elkamel, A Lohi, A Jahanmiri… - Chemical Engineering …, 2005 - Elsevier
Carbon dioxide emission is well recognized as the main source of global warming. The
catalytic hydrogenation of carbon dioxide to methanol represents an effective method for …

A regression model for plasma reaction kinetics

M Hanicinec, S Mohr, J Tennyson - Journal of Physics D: Applied …, 2023 - iopscience.iop.org
Abstract Machine learning (ML) is used to provide reactions rates appropriate for models of
low temperature plasmas with a focus on A+ B $\rightarrow $ C+ D binary chemical …

Leaching kinetics of valuable metals from waste Li-ion batteries using neural network approach

H Ebrahimzade, GR Khayati, M Schaffie - Journal of Material Cycles and …, 2018 - Springer
The kinetic study of valuable metals recovery from waste lithium-ion batteries (LIBs) using
the artificial neural network (ANN) was investigated. A multilayer feed-forward artificial …