samaneh Barani Pour | Physical Chemistry | Chemistry Breakthrough Award

Published on by Chemical Scientist

Dr. samaneh Barani Pour | Physical Chemistry | Chemistry Breakthrough Award

azarbaijan shahid madani university,Iran.

Samaneh Baranipour is a dedicated Ph.D. candidate in Physical Chemistry at the Molecular Simulation Laboratory, Faculty of Basic Sciences, Azarbaijan Shahid Madani University, Iran. In Khorramabad, Lorestan, she has cultivated a strong academic foundation and research expertise in both computational and experimental physical chemistry. Her work spans molecular dynamics simulations, density functional theory computations, and phase equilibrium measurements, with a particular interest in green solvents such as natural deep eutectic solvents. Samaneh has authored multiple peer-reviewed publications in high-impact journals and presented her findings at national and international conferences. She has also contributed as a workshop lecturer, sharing her knowledge of molecular simulations with the scientific community. Known for her precision, persistence, and passion for advancing sustainable chemical processes, she continues to pursue innovative research that bridges theory and experiment, aiming to develop eco-friendly solutions with practical industrial and pharmaceutical applications.

Professional Profile 

Samaneh Baranipour began her academic journey in Pure Chemistry at the Islamic Azad University, Khorramabad Branch, graduating with a bachelor’s degree. She then pursued a Master’s degree in Physical Chemistry at Malayer University. Her M.Sc. thesis, titled “The investigation of adsorption of nitramide molecule on the surface of pristine and Ni-functionalized gallium nitride nanotubes by computational methods,” demonstrated her early engagement with computational modeling. Building on this foundation, she embarked on her Ph.D. in Physical Chemistry at Azarbaijan Shahid Madani University, specializing in molecular simulation. Her doctoral research integrates computational and experimental approaches to explore molecular interactions, phase equilibria, and the design of green solvents, particularly natural deep eutectic solvents. This strong academic progression has provided her with comprehensive expertise in theoretical modeling, experimental measurements, and advanced computational chemistry, equipping her to contribute significantly to sustainable and innovative solutions in the chemical sciences.

Experience 

Samaneh Baranipour has accumulated extensive research experience in computational and experimental physical chemistry, with a focus on molecular dynamics simulations, density functional theory, and phase equilibrium studies. Her professional journey includes conducting advanced simulations to understand molecular interactions in green solvents, particularly natural deep eutectic systems, and analyzing their structural and dynamic properties. She has contributed to multiple high-impact publications, investigating topics such as hydrophobic and hydrophilic eutectic solvents, terpene–fatty acid interactions, and the effects of molecular composition on solvent behavior. Samaneh has presented her work at national and international scientific conferences, including the Iranian Seminar of Organic Chemistry and the International Chemistry Congress. Additionally, she has served as a workshop lecturer, training participants in molecular dynamic simulations using the NAMD package. Her experience reflects a balance between fundamental theoretical studies and practical applications, making her a versatile researcher with a strong command of both academic and applied chemistry environments.

Professional Development

Samaneh Baranipour has actively engaged in professional development to enhance her research skills and scientific contributions. She has participated in workshops and seminars that broadened her expertise in molecular simulation, nanotechnology, and green chemistry. Notably, she attended a promotional seminar introducing nanotechnology at Azarbaijan Shahid Madani University , which expanded her perspective on nanomaterials. She served as a lecturer in a workshop titled “Molecular dynamic simulation of green novel solvents using NAMD package” during the 21st ICS International Chemistry Congress, sharing her knowledge with fellow researchers. She has also presented her research findings at national and international conferences, which strengthened her scientific communication skills and professional network. Through these engagements, Samaneh has developed competencies in advanced computational techniques, interdisciplinary collaboration, and knowledge dissemination, ensuring she remains at the forefront of developments in computational chemistry, green solvent design, and sustainable chemical process research.

Skills & Expertise

Samaneh Baranipour possesses a diverse skill set that bridges computational chemistry, experimental techniques, and scientific communication. She is highly proficient in molecular dynamics simulations, density functional theory computations, and the analysis of complex molecular systems. Her expertise extends to phase equilibrium measurements, enabling her to investigate fluid-phase behaviors and extraction processes for valuable biomolecules and pharmaceuticals. She has substantial knowledge in designing and characterizing natural deep eutectic solvents, both hydrophilic and hydrophobic, for environmentally friendly applications. Samaneh is adept at using specialized computational tools, including NAMD, for simulating molecular interactions. Her laboratory skills complement her computational proficiency, allowing her to integrate theoretical modeling with experimental validation. Beyond technical expertise, she is skilled in scientific writing, data interpretation, and delivering impactful presentations at academic forums. Her ability to work across theoretical and practical domains positions her as a well-rounded researcher in physical chemistry and sustainable material development.

Resarch Focus

Samaneh Baranipour’s research focuses on advancing sustainable chemistry through the integration of computational modeling and experimental analysis. A central theme of her work is the design, characterization, and optimization of green solvents, particularly natural deep eutectic solvents (NADES). She investigates their structural and dynamic properties using molecular dynamics simulations, aiming to enhance their applications in pharmaceutical extraction, biomolecule recovery, and environmentally friendly chemical processes. Her studies also explore the role of hydrophobic and hydrophilic solvent components, fatty acid chain length, and terpene-based mixtures in influencing solvent behavior. Additionally, she has applied density functional theory to study molecular adsorption and interactions on nanostructured surfaces, contributing to the understanding of nanoscale material–molecule interactions. By combining computational predictions with experimental validation, Samaneh seeks to develop novel, efficient, and eco-friendly solvent systems that can replace conventional hazardous solvents, aligning her research with global goals for sustainable and green chemistry innovation.

Awards & Recognitions

Throughout her academic journey, Samaneh Baranipour has earned recognition for her contributions to physical chemistry research. Her work has been published in reputable international journals such as Journal of Molecular Liquids, Fluid Phase Equilibria, ChemistrySelect, and Scientific Reports, reflecting the high quality and scientific impact of her research. She has been invited to present at major conferences, including the Iranian Seminar of Organic Chemistry, the National Conference on Advanced Research in Chemistry and Chemical Engineering, and the International Chemistry Congress, where her presentations were well-received by peers and experts. Additionally, her role as a workshop lecturer on molecular dynamics simulations at an international event underscores her recognition as an emerging expert in computational chemistry and green solvent research. These achievements not only highlight her research excellence but also her commitment to advancing sustainable chemistry and fostering knowledge exchange within the global scientific community.

Publication Top Notes 

Samaneh Baranipour’s research is highly relevant to current scientific and societal needs, with strong originality in green chemistry and computational modeling. She demonstrates the intellectual capacity, technical expertise, and innovative mindset necessary for a Chemistry Breakthrough Award. While expanding her global research network, citation profile, and industry connections could further solidify her candidacy, her current achievements already make her a competitive and credible nominee.