Molecular Physics

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Title	Item sets
Beryllium oxide fullerene-like as a highly efficient sensor for formaldehyde: a DFT inspection	Publications
Lamivudine adsorption on the novel borospherene as a promising drug delivery system: a DFT study on HIV therapy	Publications
The drug delivery of Ciclopirox anticancer by ?-graphyne and its boron nitride analogue: electronic study via DFT	Publications
Investigating the sensing of B2N2 monolayer towards Eriochrome Black T: a computational study	Publications
Evaluate the potential utilisation of B3S monolayer as a novel formaldehyde gas sensor	Publications
A DFT approach towards therapeutic potential of Novel borospherene as targeted drug delivery system for isoniazid drug	Publications
DFT study on the Ciclopirox anticancer drug interaction with AlN nanostructures: analysed by AIM, UV-Vis and Marcus theory of electron-transfer	Publications
Identification of lomustine drug by graphyne-like boron nitride: DFT approach	Publications
Theoretical investigation of formaldehyde recognition by aluminum nitride nanoclusters(Al12N12): a DFT approach	Publications
Iridium(Ir) decorated silicon Carbide (SiC) nanosheet as a promising sensitive material for detection of ?-Hydroxybutyric acid drug based on the DFT approach	Publications