Combined computational approaches for developing new anti-Alzheimer drug candidates: 3D-QSAR, molecular docking and molecular dynamics studies of …
Butyrylcholinesterase is an acetylcholine-degrading enzyme involved in the memorization
process, which is becoming an interesting target for the symptomatic treatment of …
process, which is becoming an interesting target for the symptomatic treatment of …
Interaction of mancozeb with human hemoglobin: Spectroscopic, molecular docking and molecular dynamic simulation studies
Mancozeb is a broad-spectrum fungicide used extensively in agriculture to protect plants
from numerous diseases. Hemolysis of human erythrocytes on exposure to mancozeb has …
from numerous diseases. Hemolysis of human erythrocytes on exposure to mancozeb has …
Multicomponent Petasis reaction for the identification of pyrazine based multi-target directed anti-Alzheimer's agents: In-silico design, synthesis, and characterization
Multi-target directed ligands (MTDLs) have recently attracted significant interest due to their
exceptional effectiveness against multi-factorial Alzheimer's disease. The present work …
exceptional effectiveness against multi-factorial Alzheimer's disease. The present work …
Synergistic effect of chlorogenic acid and vitamin D3 (cholecalciferol) on in-vitro glycation may assist in prevention of Polycystic Ovarian Syndrome (PCOS) …
Advanced glycation end products (AGEs) are formed through non-enzymatic glycation, that
have been linked to various diseases, including polycystic ovarian syndrome (PCOS) …
have been linked to various diseases, including polycystic ovarian syndrome (PCOS) …
Rutin impedes human low-density lipoprotein from non-enzymatic glycation: A mechanistic insight against diabetes-related disorders
Glycation of human low-density protein (LDL) has an essential contribution to cardiovascular
diseases. Natural compounds like rutin have been extensively studied in preventing …
diseases. Natural compounds like rutin have been extensively studied in preventing …
Biophysical investigation of the interaction between NSAID ibuprofen and cationic biodegradable Cm-E2O2-Cm gemini surfactants
The surfactant-based drug delivery phenomenon has recently received tremendous interest
from researchers and pharmaceutical industries. Moreover, a significant shift has been …
from researchers and pharmaceutical industries. Moreover, a significant shift has been …
Studies on the interaction of 2, 4-dibromophenol with human hemoglobin using multi-spectroscopic, molecular docking and molecular dynamics techniques
Dibromophenol (DBP) has several industrial applications, including as a wood preservative
and flame retardant. This study investigated the interaction between DBP and human …
and flame retardant. This study investigated the interaction between DBP and human …
Design of Acetylcholinesterase Inhibitors as Promising Anti‐Alzheimer's Agents Based on QSAR, Molecular Docking, and Molecular Dynamics Studies of …
Cholinesterase inhibitors are promising drugs for the symptomatic treatment of Alzheimer's
disease. In the current study, we explored the quantitative structure activity relationship …
disease. In the current study, we explored the quantitative structure activity relationship …
Immobilization of laccase on poly-L-lysine modified silver nanoparticles formed by green synthesis for enhanced stability, suppressed estrogenic activity of 17β …
SFF Zofair, MA Hashmi, IH Faridi, F Rasool… - Journal of Molecular …, 2023 - Elsevier
Laccases have wide applications in diverse biotechnological industries, including
bioremediation of toxic environmental pollutants present in industrial effluents. However …
bioremediation of toxic environmental pollutants present in industrial effluents. However …
Interaction of plant phenol vanillin with human hemoglobin: A spectroscopic and molecular docking study
Z Iqbal, SFF Zofair, S Ahmed, M Sharma… - … Acta Part A: Molecular …, 2024 - Elsevier
Vanillin is a phenolic aldehyde widely used as a flavouring agent in the food industry.
Vanillin has many health benefits and has gained attention in pharmacological industries …
Vanillin has many health benefits and has gained attention in pharmacological industries …