Frontiers in Chemical Engineering | Computational Methods in Chemical Engineering

Perspective

Accepted on 19 Nov 2025

The role of chemical engineering in the organic waste-based circular bioeconomy: what has been done and what still needs to be done. A perspective

in Computational Methods in Chemical Engineering

Antoni Sánchez

Frontiers in Chemical Engineering

Original Research

Accepted on 18 Nov 2025

Steady State 1D Two-Phase Flow Differentiable Modeling, Learning from Field Data and Inverse Problem Applications in Oil Wells

in Computational Methods in Chemical Engineering

Anderson Carlos Faller
Saon Crispim Vieira
Marcelo Souza de Castro

Frontiers in Chemical Engineering

123 views

Original Research

Accepted on 10 Nov 2025

4E Comparative Analysis of Energy Transition Scenarios for the Decarbonization of a Chocolate Factory Utilities in Brazil

in Computational Methods in Chemical Engineering

Audrey Novelli Gonçalves
Francisco Mello Fonseca
Alexandre Persuhn Morawski
Pedro Rosseto Faria
José Joaquim Conceição Soares Santos

Frontiers in Chemical Engineering

180 views

Original Research

Published on 27 Oct 2025

Simulation and thermodynamic evaluation of steam cogeneration system configurations for energy recovery from exhaust gases of a carbo-chemical industry

in Computational Methods in Chemical Engineering

Alexsander Luiz Quintão
Brunella Bermudes Prati Sant’ana
Francisco Mello Fonseca
Pedro Rosseto de Faria
José Joaquim Conceição Soares Santos

Frontiers in Chemical Engineering

doi 10.3389/fceng.2025.1695423

728 views

Original Research

Published on 29 Apr 2025

Model-aided process development for scalable spray drying of sticky substances

in Computational Methods in Chemical Engineering

Ankur Kapil
Claire Wombwell
Laurel L. Kegel
Michael D. Hamlin

Frontiers in Chemical Engineering

doi 10.3389/fceng.2025.1565916

2,985 views

Brief Research Report

Published on 20 Jan 2025

Data analysis-based framework for the design and assessment of chemical process plants: a case study in amine gas-treating systems

in Computational Methods in Chemical Engineering

Rahul Gupta
Gladys Navas
Daniela Galatro

Frontiers in Chemical Engineering

doi 10.3389/fceng.2025.1490825

3,611 views
2 citations

Review

Published on 02 Dec 2024

Navigating industry 4.0 and 5.0: the role of hybrid modelling in (bio)chemical engineering’s digital transition

in Computational Methods in Chemical Engineering

Carina L. Gargalo
Alina A. Malanca
Adem R. N. Aouichaoui
Jakob K. Huusom
Krist V. Gernaey

Frontiers in Chemical Engineering

doi 10.3389/fceng.2024.1494244

5,049 views
8 citations

Original Research

Published on 25 Oct 2024

Bioprocess feeding optimization through in silico dynamic experiments and hybrid digital models—a proof of concept

in Computational Methods in Chemical Engineering

Gianmarco Barberi
Christian Giacopuzzi
Pierantonio Facco

Frontiers in Chemical Engineering

doi 10.3389/fceng.2024.1456402

3,168 views
1 citation

Perspective

Published on 29 Aug 2024

Generative artificial intelligence in chemical engineering spans multiple scales

in Computational Methods in Chemical Engineering

Benjamin Decardi-Nelson
Abdulelah S. Alshehri
Fengqi You

Frontiers in Chemical Engineering

doi 10.3389/fceng.2024.1458156

7,645 views
5 citations

Original Research

Published on 12 Jul 2024

A submerged draw down test calibration method for fully-coupled CFD-DEM modelling

in Computational Methods in Chemical Engineering

Jacob G. Wasserfall
Corné J. Coetzee
Chris J. Meyer

Frontiers in Chemical Engineering

doi 10.3389/fceng.2024.1376974

2,095 views
2 citations

Brief Research Report

Published on 06 Jun 2024

Matchmaking for industrial symbiosis: a digital tool for the identification, quantification and optimisation of symbiotic potential in industrial ecosystems

in Computational Methods in Chemical Engineering

Christos Makropoulos
Nikolaos-Alexandros Kritikos
Christodoulos Pantazis

Frontiers in Chemical Engineering

doi 10.3389/fceng.2024.1363888

3,309 views
2 citations

Original Research

Published on 21 May 2024

Systematic conceptual design strategies for the recovery of metals from E-waste

in Computational Methods in Chemical Engineering

Samarth D. Palav
Ana I. Torres
Lorenz T. Biegler

Frontiers in Chemical Engineering

doi 10.3389/fceng.2024.1388456

3,894 views
2 citations

Editorial

Published on 31 Oct 2023

Editorial: Smart manufacturing: advances and applications of artificial intelligence, machine learning and industrial internet of things in the chemical and biochemical industry

in Computational Methods in Chemical Engineering

Jesus Flores-Cerrillo
Q. Peter He
Jin Wang
Huimin Yu

Frontiers in Chemical Engineering

doi 10.3389/fceng.2023.1309165

2,703 views
3 citations

Original Research

Published on 16 Oct 2023

Data-driven structural synthesis of supercritical CO2 power cycles

in Computational Methods in Chemical Engineering

Tahar Nabil
Mohamed Noaman
Tatiana Morosuk

Frontiers in Chemical Engineering

doi 10.3389/fceng.2023.1144115

2,795 views
4 citations

Methods

Published on 07 Aug 2023

Solubilization of inclusion bodies: insights from explainable machine learning approaches

in Computational Methods in Chemical Engineering

Cornelia Walther
Michael C. Martinetz
Anja Friedrich
Anne-Luise Tscheließnig
Martin Voigtmann
Alexander Jung
Cécile Brocard
Erich Bluhmki
Jens Smiatek

Frontiers in Chemical Engineering

doi 10.3389/fceng.2023.1227620

2,928 views
3 citations

Review

Published on 12 Jul 2023

Review of synergy between machine learning and first principles models for asset integrity management

in Computational Methods in Chemical Engineering

Tianxing Cai
Jian Fang
Sharath Daida
Helen H. Lou

Frontiers in Chemical Engineering

doi 10.3389/fceng.2023.1138283

5,289 views