Zobrazeno 1 - 6
of 6
pro vyhledávání: '"Shahla Hamedani"'
Autor:
Mohadese Moradi, Shahla Hamedani
Publikováno v:
Majallah-i Dānishgāh-i ’Ulūm-i Pizishkī-i Shahīd Ṣadūqī Yazd, Vol 31, Iss 12, Pp 7321-7335 (2024)
Introduction: The purpose of using nano-carriers for drugs delivery, such as nanotubes, was slow release of drug and reducing side effects of drugs. Drugs are very active due to their many functional groups. Therefore, reactivity of drug is reduced b
Externí odkaz:
https://doaj.org/article/9dafacf7fd844e61a16c94de304fc95f
Autor:
Zahra Felegari, Shahla Hamedani
Publikováno v:
Results in Physics, Vol 7, Iss , Pp 2626-2631 (2017)
This work explores the influence of adatoms such as boron (B), nitrogen (N), and silicon (Si) on the activity of graphyne toward phosgene adsorption by the density functional theory (DFT) calculations. The adsorbent systems include virgin and doped g
Externí odkaz:
https://doaj.org/article/61b349f1fa2b47cb8ae0b814a214d07d
Autor:
Shahla Hamedani, Zahra Felegari
Publikováno v:
Letters in Organic Chemistry. 19:1034-1041
Abstract: In the current work, the adsorption of cytophosphane (cytophosphane is a chemotherapeutic drug and is used to treat several specific autoimmune diseases and malignant processes) on the (5,5) SWCNT was studied using density functional theory
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a679bc58a9a70256add41af90f0c3279
https://doi.org/10.2174/1570178619666220509095156
https://doi.org/10.2174/1570178619666220509095156
Autor:
Melina Shadi, Shahla Hamedani
Publikováno v:
Structural Chemistry. 34:905-914
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::67927144567a4476008476a1da4e4ad0
https://doi.org/10.1007/s11224-022-02050-7
https://doi.org/10.1007/s11224-022-02050-7
Autor:
Shahla Hamedani
Publikováno v:
Oriental Journal of Chemistry. 31:345-351
In this study, we studied the adsorption behavior of folic acid on the (5,0) zigzag and (5,5) armchair single-walled carbon nanotube (SWCNT) by Density Functional Theory (DFT). Geometry optimizations were carried out at the B3LYP/6-31G* level of theo
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::16617fe1cd82627d25a53be63933d896
https://doi.org/10.13005/ojc/310140
https://doi.org/10.13005/ojc/310140
Autor:
Shahla Hamedani, Zahra Felegari
Publikováno v:
Computational Condensed Matter.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::96973186d26e057518715bfda6e43710
https://doi.org/10.1016/j.cocom.2017.06.003
https://doi.org/10.1016/j.cocom.2017.06.003