[HTML][HTML] Enhancing compressive strength prediction in self-compacting concrete using machine learning and deep learning techniques with incorporation of rice husk …

MS Mahmood, A Elahi, O Zaid, Y Alashker… - Case Studies in …, 2023 - Elsevier
Focusing on sustainable development, the demand for alternative materials in concrete,
especially for Self-Compacting Concrete (SCC), has risen due to excessive cement usage …

Process Systems Engineering Tools for Optimization of Trained Machine Learning Models: Comparative and Perspective

FJ López-Flores, C Ramírez-Márquez… - Industrial & …, 2024 - ACS Publications
This article studies the relevance of innovative Process Systems Engineering (PSE) tools
that can reformulate trained machine learning models that are driven by advances in …

Insight into soft chemometric computational learning for modelling oily-wastewater separation efficiency and permeate flux of polypyrrole-decorated ceramic-polymeric …

U Baig, J Usman, SI Abba, LT Yogarathinam… - … of Chromatography A, 2024 - Elsevier
Reliable modeling of oily wastewater emphasizes the paramount importance of sustainable
and health-conscious wastewater management practices, which directly aligns with the …

[HTML][HTML] Augmenting optimization-based molecular design with graph neural networks

S Zhang, JS Campos, C Feldmann, F Sandfort… - Computers & Chemical …, 2024 - Elsevier
Computer-aided molecular design (CAMD) studies quantitative structure–property
relationships and discovers desired molecules using optimization algorithms. With the …

A Pork Price Prediction Model Based on a Combined Sparrow Search Algorithm and Classification and Regression Trees Model

J Qin, D Yang, W Zhang - Applied Sciences, 2023 - mdpi.com
The frequent fluctuation of pork prices has seriously affected the sustainable development of
the pork industry. The accurate prediction of pork prices can not only help pork practitioners …

PySCIPOpt-ML: Embedding trained machine learning models into mixed-integer programs

M Turner, A Chmiela, T Koch, M Winkler - arXiv preprint arXiv:2312.08074, 2023 - arxiv.org
A standard tool for modelling real-world optimisation problems is mixed-integer
programming (MIP). However, for many of these problems there is either incomplete …

Global optimization: a machine learning approach

D Bertsimas, G Margaritis - Journal of Global Optimization, 2024 - Springer
Many approaches for addressing global optimization problems typically rely on relaxations
of nonlinear constraints over specific mathematical primitives. This is restricting in …

[HTML][HTML] Deep learning enhanced mixed integer optimization: Learning to reduce model dimensionality

N Triantafyllou, MM Papathanasiou - Computers & Chemical Engineering, 2024 - Elsevier
This work introduces a framework to address the computational complexity inherent in Mixed
Integer Programming (MIP) models by harnessing the potential of deep learning. By …

[HTML][HTML] Multiscale optimization of formic acid dehydrogenation process via linear model decision tree surrogates

EM Sunshine, G Bucci, T Chatterjee, S Deo… - Computers & Chemical …, 2025 - Elsevier
Multiscale optimization problems require the interconnection of several models of distinct
phenomena which occur at different scales in length or time. However, the best model for …

Beyond the fourth paradigm of modeling in chemical engineering

JR Kitchin, V Alves, CD Laird - Nature Chemical Engineering, 2025 - nature.com
Differentiable programming underpins the foundations of machine learning, and enables
new approaches to solving chemical engineering problems. This Comment discusses the …