The enthralling effect of packing on the light emission of pyridazinone based luminophore: Crystallographic, electronic absorption and computational studies
The present study unfolds the synthesis and characterization of a new butylidine linked
hetero dimer of pyridazinone (PNP). The crystal structure analysis of PNP reveals that it …
hetero dimer of pyridazinone (PNP). The crystal structure analysis of PNP reveals that it …
Computational insights into the adsorption of norepinephrine neurotransmitter onto B12N12 nanocage
T Yadav, E Shakerzadeh, S Goswami… - Diamond and Related …, 2024 - Elsevier
The present study reports the adsorption behaviour of norepinephrine neurotransmitter onto
boron nitride (B 12 N 12) nanocage to explore its suitability for targeted drug delivery. The …
boron nitride (B 12 N 12) nanocage to explore its suitability for targeted drug delivery. The …
Efficient dissolution of cellulose in slow-cooling alkaline systems and interacting modes between alkali and urea at the molecular level
S Ai, Z Huang, W Yu, C Huang - Carbohydrate Research, 2024 - Elsevier
The dissolution of microcrystalline cellulose (MCC) in a urea-NaOH system is beneficial for
its mechanical processing. The apparent MCC solubility was greatly improved to 14 wt …
its mechanical processing. The apparent MCC solubility was greatly improved to 14 wt …
Gas-phase conformational analysis and vibrational signatures of diphenhydramine: Investigating the interplay with hydrochloride
We have performed a comprehensive analysis of the conformational and vibrational
spectroscopic properties of Diphenhydramine in the gas phase using potential energy …
spectroscopic properties of Diphenhydramine in the gas phase using potential energy …
Revealing metabolic path of Ketamine catalyzed by CYP450 via quantum mechanical approach
N Awasthi, R Yadav, D Kumar - Journal of Molecular Structure, 2023 - Elsevier
Ketamine is essential medication used in anesthesia. This drug is metabolized by CYP450
enzyme, found in human liver. After metabolism they form product called metabolites. It takes …
enzyme, found in human liver. After metabolism they form product called metabolites. It takes …
Resolution characteristic measure of trimetallic Au/Pt/Cu based nano-fluids and TiO2 nano-films by using parametric indirect microscopy for biological application
NP Yadav, Z Yao - Journal of Optics, 2023 - Springer
In biology, nanoparticles play a crucial role in making antibacterial medicine for different
diseases and have been widely used for anti-counterfeiting and security purposes. We have …
diseases and have been widely used for anti-counterfeiting and security purposes. We have …
Conformational Search and Spectroscopic Analysis of Biorelevant Molecule: 5-Chloro-2-hydroxy-N-isobutyl-3-oxo-2,3-dihydrobenzofuran-2-carboxamide
The present communication deals with the conformational, vibrational spectroscopic
analysis and molecular docking study of an important biorelevant molecule namely 5-Chloro …
analysis and molecular docking study of an important biorelevant molecule namely 5-Chloro …
High solubility of cellulose in slow-cooling alkaline systems and interacting modes of alkali and urea at the molecular level
S Ai, Z Huang, W Yu, C Huang - 2023 - researchsquare.com
The dissolution of microcrystalline cellulose (MCC) in a urea-NaOH system is beneficial for
its mechanical processing, but the solubility has been low. The MCC solubility was greatly …
its mechanical processing, but the solubility has been low. The MCC solubility was greatly …