Introduction: Quantitative structure-activity/property relationships (QSAR/QSPR) are
statistical models which quantitatively correlate quantitative chemical structure information …

The aquatic ecosystem is the final destination of most industrial residues and agrochemicals
resulting in organisms being exposed to a complex mixture of contaminants. Nanomaterials …

Protein–protein interactions (PPI) are vital in modulating biochemical pathways in many
biological processes. Inhibiting PPI is a tremendously important diagnostic and therapeutic …

Aim: This study was performed to identify the interaction of six types of black rice
anthocyanin towards TNF-α protein and TNF-α receptor through in silico studies, to assess …

Protein–protein interactions (PPIs) are tremendously important for the function of many
biological processes. However, because of the structure of many protein–protein interfaces …

Osteoporosis is a type of bone loss disease characterized by a reduction in bone mass and
microarchitectural deterioration of bone tissue. With the intensification of global aging, this …

Synovial fibroblasts (SFs) are key pathogenic drivers in rheumatoid arthritis (RA). Their in
vivo activation by TNF is sufficient to orchestrate full arthritic pathogenesis in animal models …

Middle ear cholesteatoma (MEC), is a destructive, and locally invasive lesion in the middle
ear driven by inflammation with an annual incidence of 10 per 100,000. Surgical …

The increasing use of nanoparticles (NPs) in a wide range of consumer and industrial
applications has necessitated significant effort to address the challenge of characterizing …

Artificial intelligence (AI) has been recognized as a powerful technique that can accelerate
drug discovery during the hit compound identification step. However, most simple deep …