The computational investigation of the role of pristine and metal-doped BC2N nanotubes for sensitive detection of ciclopirox drug
- Title
- The computational investigation of the role of pristine and metal-doped BC2N nanotubes for sensitive detection of ciclopirox drug
- Abstract
- Even though Ciclopirox (CPX) plays a critical role in the treatment of pancreatic, colorectal, and breast cancers, some side effects are attributable to CPX. Thus, determining the content of CPX in biological specimens is critical. The contribution of CPX to the activity of the intrinsic and Au-decorated BC2N nanotubes (BC2NNT) has been analyzed in this research by employing density functional theory estimations. According to the results, the gold decoration resulted in a noticeable improvement in BC2NNT toward CPX and increased value of BC2NNT sensing response from 9.3 to 307.1. Furthermore, a short recovery was allowed (approximately 1.12 sec) in order to desorb CPX from the Au@BC2NNT exterior. The CPX-Au@ BC2NNT interaction decreased in the aqueous solution, which led to a declined Au@BC2NNT sensing response from a value of 307.1 to 260.0. However, in accordance with our results, by employing the gold-doping process, one may transform BC2NNT into an appropriate sensor for CPX.
- Scientific Type
- غير معروف
- Journal volume
- Volume 1241
- Collaboration type
- مشترك
- Publish Date
- September 15, 2024
- Participated Universities (Publication)
-
Alnoor University
- Scopus status
- In Scopus
- Scopus index year
- 2 024
- Scopus quarter
- 2
- Scopus citation score
- 4.400000095
- Clarivate status
- In Clarivate
- Clarivate index year
- 2 024
- Clarivate impafact
- 2.289999962
- Pub. Med. status
- Not In PubMed
- Author (Publication)
- إسراء احمد سعيد حمو
- Journal (Publication)
- Computational and Theoretical Chemistry
- Publisher (Publication)
-
Elsevier
- ISSN
- 2210-271X
- Country (Publication)
-
Netherlands
- Country type
- عالمية
- College (Publication)
-
College of Dentistry
- Departement (Publication)
-
Department of Dentistry