Multispectroscopic and molecular modeling strategy to explore the interaction of cholest-5-en-7-one with human serum albumin: DFT and Hirshfeld surface analysis
The present study accounts for cholest-5-en-7-one (steroid) synthesis using selenium dioxide and silica as well as its identification using high-resolution mass spectrometry (HRMS), FT-IR, NMR, and elemental analysis. Density functional theory (DFT) calculations were used to optimize the steroid...
Guardado en:
Autor principal: | Mahboob Alam |
---|---|
Formato: | article |
Lenguaje: | EN |
Publicado: |
Elsevier
2021
|
Materias: | |
Acceso en línea: | https://doaj.org/article/3e05616b286e419bb3387d0c227c27ba |
Etiquetas: |
Agregar Etiqueta
Sin Etiquetas, Sea el primero en etiquetar este registro!
|
Ejemplares similares
-
Repurposing benzimidazole and benzothiazole derivatives as potential inhibitors of SARS-CoV-2: DFT, QSAR, molecular docking, molecular dynamics simulation, and in-silico pharmacokinetic and toxicity studies
por: Ranjan K. Mohapatra, et al.
Publicado: (2021) -
Exploring the Interaction of Cobalt Oxide Nanoparticles with Albumin, Leukemia Cancer Cells and Pathogenic Bacterial by Multispectroscopic, Docking, Cellular and Antibacterial Approaches
por: Arsalan N, et al.
Publicado: (2020) -
Computational Studies of Some Hydrazone Derivatives as Antibacterial Agent: DFT and Docking Methods
por: Abel Oyebamiji, et al.
Publicado: (2019) -
A FACILE SYNTHESIS OF 6,7-FUSED STEROIDAL THIAZOLES VIA 1,3-INTRAMOLECULAR MIGRATION OF BROMINE/ALLYLIC DISPLACEMENT OF BROMINE
por: ALAM,MAHBOOB, et al.
Publicado: (2008) -
DFT and Molecular Docking Investigation of Potential Anticancer Properties of Some Flavonoids
por: EHIMEN ANNASTASIA ERAZUA, et al.
Publicado: (2019)