Amin Reza Zolghadr

11PUBLICATIONS
5CO-AUTHORS
Computational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Structure and dynamics of materialsCheminformatics and quantitative structure-activity relationshipsStatistical mechanics in chemistrySurface water quality processes and contaminated sediment assessment
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Publications (11)

|Oct 18, 2025
Structure, Dynamics, and Interfacial Behavior in Ionic Liquid-Alcohol Binary Mixtures: A Molecular Dynamics Simulation Study.

Maryam Behzadi, Maryam Heydari Dokoohaki, Amin Reza Zolghadr

|Aug 15, 2025
Structural and interfacial behavior of choline chloride-based DESs (CholCl:EG and CholCl:urea) at various weight percentages in water mixture.

Rokhsareh Khodabandeh, Amin Reza Zolghadr

|Jul 08, 2025
Solvation and aggregation of heteroaromatic drugs in the Reline deep eutectic solvent - a combined molecular dynamics simulation and DFT study.

Narges Karimi, Maryam Heydari Dokoohaki, Amin Reza Zolghadr

|Nov 29, 2023
Electronic origins of the stereochemistry in β-lactam formed through the Staudinger reaction catalyzed by a nucleophile.

Farideh Pahlavan, Sedigheh Saddat Moosavi, Amin Reza Zolghadr

|Nov 13, 2023
Effect of quaternary ammonium surfactants on biomembranes using molecular dynamics simulation.

Sedigheh Saddat Moosavi, Amin Reza Zolghadr

|May 06, 2022
Interactions of neutral gold nanoparticles with DPPC and POPC lipid bilayers: simulation and experiment.

Amin Reza Zolghadr, Sedigheh Saddat Moosavi

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Frequent Collaborators

4 joint publications

Maryam Heydari Dokoohaki

2 joint publications

Axel Klein

1 joint publications

Mohammad Hadi Ghatee

1 joint publications

Seyed Masoom Masoompour