Vote for your favorite mineral in #MinCup25! - Topaz vs. Kyanite
It's a battle of high-pressure colourful beauties of #topaz vs #kyanite. Which can stand the heat of round 1?
Log InRegister
Quick Links : The Mindat ManualThe Rock H. Currier Digital LibraryMindat Newsletter [Free Download]
Home PageAbout MindatThe Mindat ManualHistory of MindatCopyright StatusWho We AreContact UsAdvertise on Mindat
Donate to MindatCorporate SponsorshipSponsor a PageSponsored PagesMindat AdvertisersAdvertise on Mindat
Learning CenterWhat is a mineral?The most common minerals on earthInformation for EducatorsMindat ArticlesThe ElementsThe Rock H. Currier Digital LibraryGeologic Time
Minerals by PropertiesMinerals by ChemistryAdvanced Locality SearchRandom MineralRandom LocalitySearch by minIDLocalities Near MeSearch ArticlesSearch GlossaryMore Search Options
Search For:
Mineral Name:
Locality Name:
Keyword(s):
 
The Mindat ManualAdd a New PhotoRate PhotosLocality Edit ReportCoordinate Completion ReportAdd Glossary Item
Mining CompaniesStatisticsUsersMineral MuseumsClubs & OrganizationsMineral Shows & EventsThe Mindat DirectoryDevice SettingsThe Mineral Quiz
Photo SearchPhoto GalleriesSearch by ColorNew Photos TodayNew Photos YesterdayMembers' Photo GalleriesPast Photo of the Day GalleryPhotography

Rahimi, Rezvan, Solimannejad, Mohammad (2023) Covalent triazine-based monolayer with dual application in sensing and delivery of mercaptopurine anticancer drug: a periodic DFT study. Molecular Physics, 121 (21) doi:10.1080/00268976.2023.2231093

Advanced
   -   Only viewable:
Reference TypeJournal (article/letter/editorial)
TitleCovalent triazine-based monolayer with dual application in sensing and delivery of mercaptopurine anticancer drug: a periodic DFT study
JournalMolecular Physics
AuthorsRahimi, RezvanAuthor
Solimannejad, MohammadAuthor
Year2023 (November 2)Volume121
Issue21
PublisherInforma UK Limited
DOIdoi:10.1080/00268976.2023.2231093Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID16960066Long-form Identifiermindat:1:5:16960066:4
GUID0
Full ReferenceRahimi, Rezvan, Solimannejad, Mohammad (2023) Covalent triazine-based monolayer with dual application in sensing and delivery of mercaptopurine anticancer drug: a periodic DFT study. Molecular Physics, 121 (21) doi:10.1080/00268976.2023.2231093
Plain TextRahimi, Rezvan, Solimannejad, Mohammad (2023) Covalent triazine-based monolayer with dual application in sensing and delivery of mercaptopurine anticancer drug: a periodic DFT study. Molecular Physics, 121 (21) doi:10.1080/00268976.2023.2231093
In(2023, November) Molecular Physics Vol. 121 (21) Informa UK Limited

See Also

These are possibly similar items as determined by title/reference text matching only.

Rahimi, Rezvan, Solimannejad, Mohammad, Ehsanfar, Zeynab (2022) Potential application of XC3 (X = B, N) nanosheets in drug delivery of hydroxyurea anticancer drug: a comparative DFT study. Molecular Physics, 120 (6) doi:10.1080/00268976.2021.2014587
Rahimi, Rezvan, Solimannejad, Mohammad, Ehsanfar, Zeynab (2022) High sensitivity of 2D covalent triazine framework for recognition of NO, NO2, and HO2 radicals: A periodic DFT study. Chemical Physics Letters, 805. 139940 doi:10.1016/j.cplett.2022.139940
Rahimi, Rezvan, Solimannejad, Mohammad (2020) BC3 graphene-like monolayer as a drug delivery system for nitrosourea anticancer drug: A first-principles perception. Applied Surface Science, 525. 146577pp. doi:10.1016/j.apsusc.2020.146577
Rahimi, Rezvan, Solimannejad, Mohammad, Soleimannejad, Mostafa (2022) Two-dimensionalcovalent triazine frameworks as superior nanocarriers for the delivery of thioguanine anti-cancer drugs: a periodic DFT study. New Journal of Chemistry, 46 (32) 15635-15644 doi:10.1039/d2nj02050e
Rahimi, Rezvan, Solimannejad, Mohammad (2023) Sensing response of pentagonal B2C nanosheet towards VOCs: A study combining DFT and molecular dynamics simulations. Chemical Physics, 574. Elsevier BV. 112042 doi:10.1016/j.chemphys.2023.112042
Gholami, Rezvan, Solimannejad, Mohammad (2022) Potential of B24N24 nanocluster for sensing and delivering aloe-emodin anticancer drug: A DFT study. Journal of Molecular Structure, 1270. Elsevier BV. 133968 doi:10.1016/j.molstruc.2022.133968
Rahimi, Rezvan, Solimannejad, Mohammad (2021) Hydrogen storage on pristine and Li-decorated BC6N monolayer from first-principles insights. Molecular Physics, 119 (5) doi:10.1080/00268976.2020.1827177
Rahimi, Rezvan, Solimannejad, Mohammad, Soleimannejad, Majid (2024) Increasing the cell voltage of a magnesium ion battery with B 24 O 24 anode through encapsulating halides: a DFT study. Molecular Physics, 122 (4) doi:10.1080/00268976.2023.2252107
Rahimi, Rezvan, Solimannejad, Mohammad (2021) Gas-sensing performance of BC3 nanotubes for detecting poisonous cyanogen gas: a periodic DFT approach. New Journal of Chemistry, 45 (26) 11574-11584 doi:10.1039/d1nj01977e
Rahimi, Rezvan, Solimannejad, Mohammad, Horri, Ashkan (2024) DFT study of the adsorption properties and sensitivity of a B2N monolayer toward harmful gases. Scientific Reports, 14 (1). doi:10.1038/s41598-024-77659-1
Rahimi, Rezvan, Solimannejad, Mohammad (2021) Periodic DFT insights into hydrogen storage of a B4CN3 nanosheet. New Journal of Chemistry, 45 (5) 2463-2469 doi:10.1039/d0nj05652a
 
and/or  
Mindat.org is an outreach project of the Hudson Institute of Mineralogy, a 501(c)(3) not-for-profit organization.
Copyright © mindat.org and the Hudson Institute of Mineralogy 1993-2025, except where stated. Most political location boundaries are Β© OpenStreetMap contributors. Mindat.org relies on the contributions of thousands of members and supporters. Founded in 2000 by Jolyon Ralph.
To cite: Ralph, J., Von Bargen, D., Martynov, P., Zhang, J., Que, X., Prabhu, A., Morrison, S. M., Li, W., Chen, W., & Ma, X. (2025). Mindat.org: The open access mineralogy database to accelerate data-intensive geoscience research. American Mineralogist, 110(6), 833–844. doi:10.2138/am-2024-9486.
Privacy Policy - Terms & Conditions - Contact Us / DMCA issues - Report a bug/vulnerability Current server date and time: September 13, 2025 17:16:08
Go to top of page