Exploration of Potential Anti-Inflammatory Cum Anti-Rheumatoid-Arthritis Phyto-Molecule Through Integrated Green Approach: Network Pharmacology, Molecular Docking, Molecular Dynamics, In-Vitro and Ex-Vivo Study.

Rheumatoid arthritis (RA) and associated inflammatory complications are the most prevalent illnesses and can turn into fatal conditions if left untreated. Allopathic medicine is not satisfactory for curing RA. Scientific literature reports reveal that several phyto-compounds viz.

R software for QSAR analysis in phytopharmacological studies.

Introduction: In recent decades, quantitative structure-activity relationship (QSAR) analysis has become an important method for drug design and natural product research. With the availability of bioinformatic and cheminformatic tools, a vast number of descriptors have been generated, making it challenging to select potential independent variables that are accurately related to the dependent response variable.

Objective: The objective of this study is to demonstrate various descriptor selection procedures, such as the Boruta approach, all subsets regression, the ANOVA approach, the AIC method, stepwise regression, and genetic algorithm, that can be used in QSAR studies.

A novel phytochemical from Dipteris wallichii inhibits human β-secretase 1: Implications for the treatment of Alzheimer's disease.

Alzheimer's disease (AD) is the most prevalent progressive neurodegenerative disease, and the most common cause of dementia. One of the histopathological hallmarks of AD is the accumulation of extracellular amyloid-β (Aβ) oligomers as neuritic plaques in brain. The Aβ oligomers are produced from amyloid precursor protein by the action of secretase enzymes, among which β-secretase 1 (BACE1) catalyses the rate-limiting step.

Effect of Thermal Conductivity on Enhanced Evaporation of Water Droplets from Heated Graphene-PDMS Composite Surfaces.

The dynamics of evaporating water droplets on heated graphene-poly(dimethylsiloxane) (PDMS) composites is investigated experimentally and theoretically. By inserting graphene nucleates in PDMS, we report the effect of change in thermal resistance on the evaporation process of water droplets on the heated graphene-PDMS composite surface. By dispersing graphene within the PDMS matrix, the evaporation of water droplets is enhanced.