The feasibility of in-silico techniques, together with the computational framework, has been
applied to predictive bioremediation aiming to clean-up contaminants, toxicity evaluation …

The aim of docking is to accurately predict the structure of a ligand within the constraints of a
receptor binding site and to correctly estimate the strength of binding. We discuss, in detail …

Protein-ligand docking is currently an important tool in drug discovery efforts and an active
area of research that has been the subject of important developments over the last decade …

Aquaculture has witnessed an excellent growth rate during the last two decades and offers
huge potential to provide nutritional as well as livelihood security. Genomic research has …

(piperazin-1-yl) single bond N-(1H-pyrazolo [3, 4-b] pyridin-3-yl) acetamides are described
as a new class of selective and potent acetylcholinesterase (AChE) inhibitors and amyloid β …

Artemisinin constitutes the frontline treatment to aid rapid clearance of parasitaemia and
quick resolution of malarial symptoms. However, the widespread promiscuity about its …

Vibrio cholerae is the causal organism of the cholera epidemic, which is mostly prevalent in
developing and underdeveloped countries. However, incidences of cholera in developed …

In our endeavor towards the development of potent multitarget ligands for the treatment of
Alzheimer's disease, a series of triazine-triazolopyrimidine hybrids were designed …

In the current era of modern drug design & development via computer-aided drug design,
the potential role of computational software tools is widely enlarged in use. Computer-based …

Severe acute respiratory syndrome coronavirus 2 (SARS‐CoV‐2) has a single‐stranded
RNA genome that encodes 14 open reading frames (ORFs), eight of which encode …