MOFs as versatile catalysts: synthesis strategies and applications in value-added compound production

RE Malekshah, M Moharramnejad, S Gharanli… - ACS …, 2023 - ACS Publications
Catalysts played a crucial role in advancing modern human civilization, from ancient times to
the industrial revolution. Due to high cost and limited availability of traditional catalysts, there …

Computational methods for adsorption study in wastewater treatment

A Malloum, KA Adegoke, JO Ighalo, J Conradie… - Journal of Molecular …, 2023 - Elsevier
Computation methods or molecular simulations can be used to identify materials with high
adsorption capacity for wastewater treatment rapidly. They can also provide complementary …

Assessing cationic dye adsorption mechanisms on MIL-53 (Al) nanostructured MOF materials using quantum chemical and molecular simulations: Toward …

I Salahshoori, MN Jorabchi, S Ghasemi… - Journal of Water …, 2023 - Elsevier
The escalating levels of environmental pollutants, particularly cationic dyes, present a
significant ecological threat. Cationic dyes such as rhodamine B (RB) and methylene blue …

pH-Sensitive adsorption of gastrointestinal drugs (famotidine and pantoprazole) as pharmaceutical pollutants by using the Au-doped@ ZIF-90-glycerol adsorbent …

N Montazeri, I Salahshoori, P Feyzishendi… - Journal of Materials …, 2023 - pubs.rsc.org
Pharmaceutical pollutants, such as gastrointestinal drugs, pose a significant environmental
concern due to their widespread use and potential adverse effects on ecosystems. Insights …

[HTML][HTML] Novel hybrid QSPR-GPR approach for modeling of carbon dioxide capture using deep eutectic solvents

I Salahshoori, A Baghban, A Yazdanbakhsh - RSC advances, 2023 - pubs.rsc.org
In recent years, deep eutectic solvents (DESs) have garnered considerable attention for their
potential in carbon capture and utilization processes. Predicting the carbon dioxide (CO2) …

[HTML][HTML] Simulation-based approaches for drug delivery systems: navigating advancements, opportunities, and challenges

I Salahshoori, M Golriz, MAL Nobre, S Mahdavi… - Journal of Molecular …, 2023 - Elsevier
Efficient drug delivery systems (DDSs) play a pivotal role in ensuring pharmaceuticals'
targeted and effective administration. However, the intricate interplay between drug …

[HTML][HTML] Molecular dynamics simulation of Pt@ Au nanoalloy in various solvents: Investigation of solvation, aggregation, and possible coalescence

MN Jorabchi, M Abbaspour, EK Goharshadi… - Journal of Materials …, 2023 - Elsevier
In this study, a pair of core-shell Pt@ Au nanoalloy particles with 309 atoms was simulated in
various solvents, including water, benzene, ethanol, water+ benzene, and 1-butyl-1, 1, 1 …

Synergistic enhancement of pollutant removal from water by using BiOCl/BiOBr heterojunction on clay surface and sunlight irradiation

H Ighnih, H Ouachtak, RE Malekshah… - Journal of Water …, 2024 - Elsevier
New photocatalysts based on kaolinite-supported BiOCl x Br (1-x) solid solution
nanocomposites (BiOCl x Br (1-x)@ Kaol), were synthetized by using ecofriendly co …

Integrative analysis of multi machine learning models for tetracycline photocatalytic degradation with MOFs in wastewater treatment

I Salahshoori, MN Jorabchi, A Baghban, HA Khonakdar - Chemosphere, 2024 - Elsevier
This study focuses on the utilization of connectionist models, specifically Independent
Component Analysis (ICA), Genetic Algorithm (GA), Particle Swarm Optimization (PSO), and …

A comprehensive study on transport behaviour and physicochemical characteristics of PU/based 3-phase mixed matrix membranes: Effect of [HNMP][HSO4] ionic …

M Asghari, I Salahshoori, S Salmani… - Separation and …, 2024 - Elsevier
The gas separation industry has witnessed a significant focus on mixed matrix membranes
(MMMs) due to their exceptional potential, surpassing the performance of conventional …