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Volume & Issue: Volume 1, Issue 1, June 2025 
Number of Articles: 6
Investigating variability in PLGA monomers: A comparative study of electronic properties and their role in drug delivery systems

Pages 1-8

Laleh Khorshidi; Davood Farmanzadeh; Sima Esmailpour

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  • PDF 1.25 M

Intramolecular hydrogen bond and tautomeric stability of 5-Bromo-salicylideneiminpo-ethylimino-pentan-2-one

Pages 9-15

Vahidreza Darugar; Mahmood Akbari; Ali Reza Berenji

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  • PDF 954.05 K

Electronic transport behavior of 4,5-bis(2,5-dimethylthiophen-3-yl)furan-2-amine (a Diarylethene) as optical molecular switch: A first-principles approach

Pages 16-21

Ayoub Kanaani; Mohammad Vakili; Mahmood Akbari

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  • PDF 1.09 M

Hypoxanthine: A DFT Investigation of Tautomerism and Nonlinear Optical Behavior

Pages 22-29

Sima Esmailpour; Hossein Nikoofard; Mohsen Sargolzaei

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  • PDF 1.07 M

DFT study on interaction of triacetin with some chemical compounds in cigarette smoke

Pages 30-43

Abdol Hossein Masoudi Gazi; Gholam Reza Moradi Robati

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  • PDF 1.45 M

A multiscale study of Hydrogen bonding in Geminal Dicationic Ionic liquids 1,3- bis[3-methylimidazolium-1-yl]butane Halides

Pages 44-56

Saeid Yeganegi; Azim Soltanabadi

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  • PDF 1.55 M

Journal of Nano Simulation
Issue 1
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