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Journal of Biomolecular Structure & Dynamics|July 24, 2018
A density functional theory-based analysis of the structural, topological and electronic properties of gemcitabine drug adsorption on the pyrrolidine functionalized single-walled carbon nanotubeHeidar Moradnia, Heidar Raissi, Akbar BakhtiariJournal of Biomolecular Structure & Dynamics|May 24, 2019
Predicting doxorubicin drug delivery by single-walled carbon nanotube through cell membrane in the absence and presence of nicotine molecules: a molecular dynamics simulation studyMajid Pakdel, Heidar Raissi, Mahnaz ShahabiJournal of Molecular Graphics & Modelling|May 22, 2021
Assessment of the effect of external and internal triggers on adsorption and release of paclitaxel from the PEI functionalized silicene nanosheet: A molecular dynamic simulationLeila Razavi, Heidar Raissi, Farzaneh FarzadScientific Reports|August 5, 2024
Selective detection of food contaminants using engineered gallium-organic frameworks with MD and metadynamics simulationsSomayeh Hamsayegan, Heidar Raissi, Afsaneh GhahariScientific Reports|July 29, 2024
Examine stability polyvinyl alcohol-stabilized nanosuspensions to overcome the challenge of poor drug solubility utilizing molecular dynamic simulationSedigheh Abdollahi, Heidar Raissi, Farzaneh FarzadLangmuir : the ACS Journal of Surfaces and Colloids|April 22, 2026
Engineered Halloysite-CoFeO4-Au Nanohybrids for Selective Adsorption of Aromatic Pollutants: A Molecular-Level Study of Surface InteractionsSomayeh Hamsayegan, Heidar Raissi, Alireza NakhaeiScientific Reports|December 31, 2024
Engineered crystalline polymers for effective contaminant removal from waterHadiseh Heydari, Heidar Raissi, Afsaneh GhahariScientific Reports|February 15, 2023
Validation of an MD simulation approach for electrical field responsive micelles and their application in drug deliveryLeila Razavi, Heidar Raissi, Farzaneh FarzadScientific Reports|July 24, 2025
The role of microplastics as vectors of antibiotic contaminants via a molecular simulation approachSedigheh Abdollahi, Heidar Raissi, Farzaneh FarzadRSC Advances|May 6, 2022
Development and evaluation of a pH-responsive and water-soluble drug delivery system based on smart polymer coating of graphene nanosheets: an in silico studyAbutaleb Alinejad, Heidar Raissi, Hassan HashemzadehPageof 6