Zobrazeno 1 - 10
of 37
pro vyhledávání: '"Sepideh Ketabi"'
Publikováno v:
BMC Chemistry, Vol 18, Iss 1, Pp 1-19 (2024)
Abstract In this study, efficiency of functionalized carbon nanotube as a potential delivery system for imatinib anti-cancer drug was investigated. Accordingly, carboxyl and hydroxyl functionalized carbon nanotube were inspected as a notable candidat
Externí odkaz:
https://doaj.org/article/d8bd67976b0d465da7453bedef687f11
Publikováno v:
BMC Chemistry, Vol 17, Iss 1, Pp 1-19 (2023)
Abstract The improvement of the solubility of sulfasalazine in physiological media was the major aim of this study. Accordingly, BNNT inspected as a notable candidate for the carriage of this drug in aqueous media. For this purpose, four possible int
Externí odkaz:
https://doaj.org/article/0ad8aa0bc2f64d2b9ec6ce5dcd7354c1
Publikováno v:
شیمی کاربردی روز, Vol 10, Iss 37, Pp 63-70 (2016)
Hydrogen storage capacity of defected graphene was studied by first-principles theory based on Density-functional calculations. Adsorption of molecular hydrogen on a defected graphene V2(5-8-5) and lithium doped defected graphene V2(5-8-5) was carrie
Externí odkaz:
https://doaj.org/article/0bd8e94122994374b128b75f8f2295c5
Publikováno v:
Journal of Cluster Science. 34:1499-1509
Publikováno v:
Journal of Receptors and Signal Transduction. 42:503-511
Mycobacterium tuberculosis (Mtb) is the causative agent of infectious diseases worldwide. Oxadiazole derivatives have many biological activities and can be a good alternative to antimicrobial drugs. In this study, the quantitative structure-activity
Publikováno v:
New Journal of Chemistry. 46:8827-8837
The first report of quasi-SMILES-based QSPR models for CO2 capture of MOFs based on experimental data.
Publikováno v:
Structural Chemistry.
Publikováno v:
Separation Science and Technology. 57:1376-1391
The CO2 capture from gas mixtures is of great importance in the industry in terms of improving the quality of natural gas. Proficient adsorbents should reveal high CO2 capacity and also high CO2 se...
Publikováno v:
Journal of Cluster Science. 33:135-143
To show the potential application of gold clusters as a drug delivery system, simulation results of thioguanine interaction with Aun clusters in water were discussed in this research. First, quantum mechanical calculations were used to model Aun clus
Publikováno v:
Structural Chemistry. 32:869-877
Encapsulation of chlorambucil, cyclophosphamide, and melphalan with (9,9) carbon nanotube was investigated in aqueous solution. The structures were modeled in gas phase applying density functional calculations. Then, solvation free energies and assoc