A machine learning approach for corrosion small datasets

T Sutojo, S Rustad, M Akrom, A Syukur… - npj materials …, 2023 - nature.com
In this work, we developed a QSAR model using the K-Nearest Neighbor (KNN) algorithm to
predict the corrosion inhibition performance of the inhibitor compound. To overcome the …

A critical review of coordination chemistry of pyrimidine and pyridazine compounds: Bonding, chelation and corrosion inhibition

TW Quadri, ED Akpan, SE Elugoke, O Dagdag… - Coordination Chemistry …, 2025 - Elsevier
Metallic deterioration remains a formidable challenge in numerous industrial sectors,
necessitating the continuous, intense search for effective, sustainable and non-toxic …

Development of quantum machine learning to evaluate the corrosion inhibition capability of pyrimidine compounds

M Akrom, S Rustad, HK Dipojono - Materials Today Communications, 2024 - Elsevier
This investigation employs a quantum neural network (QNN) synergistically integrated with a
quantitative structure-property relationship (QSPR) model for the comprehensive evaluation …

Data-driven investigation to model the corrosion inhibition efficiency of Pyrimidine-Pyrazole hybrid corrosion inhibitors

M Akrom, S Rustad, AG Saputro… - … and Theoretical Chemistry, 2023 - Elsevier
This paper proposes a quantitative structure–property relationship model (QSPR) based on
machine learning (ML) for a pyrimidine-pyrazole hybrid as a corrosion inhibitor. Based on …

A combination of machine learning model and density functional theory method to predict corrosion inhibition performance of new diazine derivative compounds

M Akrom, S Rustad, AG Saputro, A Ramelan… - Materials Today …, 2023 - Elsevier
This study proposes a novel approach that combines machine learning (ML) and density
functional theory (DFT) methods to construct a quantitative structure-properties relationship …

A machine learning approach to predict the efficiency of corrosion inhibition by natural product-based organic inhibitors

M Akrom, S Rustad, HK Dipojono - Physica Scripta, 2024 - iopscience.iop.org
This paper presents a quantitative structure–property relationship (QSPR)-based machine
learning (ML) framework designed for predicting corrosion inhibition efficiency (CIE) values …

Prediction of Anti-Corrosion performance of new triazole derivatives via Machine learning

M Akrom, S Rustad, HK Dipojono - Computational and Theoretical …, 2024 - Elsevier
This paper endeavors to present an in-depth investigation into the corrosion inhibition
efficiency (CIE) of novel triazole derivatives serving as corrosion inhibitors. Among the array …

[HTML][HTML] Variational quantum circuit-based quantum machine learning approach for predicting corrosion inhibition efficiency of pyridine-quinoline compounds

M Akrom, S Rustad, HK Dipojono - Materials Today Quantum, 2024 - Elsevier
This work used a variational quantum circuit (VQC) in conjunction with a quantitative
structure-property relationship (QSPR) model to completely investigate the corrosion …

Applications of conceptual density functional theory in reference to quantitative structure–activity/property relationship

P Sharma, P Ranjan, T Chakraborty - Molecular Physics, 2024 - Taylor & Francis
To predict the biological effects of chemical compounds based on mathematical and
statistical relationships, quantitative structure–activity relationship (QSAR) approach is used …

Multilayer perceptron neural network-based QSAR models for the assessment and prediction of corrosion inhibition performances of ionic liquids

TW Quadri, LO Olasunkanmi, OE Fayemi… - Computational Materials …, 2022 - Elsevier
The present study reports the quantum chemical studies and quantitative structure activity
relationship (QSAR) modeling of thirty ionic liquids utilized as chemical additives to repress …