In modern drug discovery, the combination of chemoinformatics and quantitative structure–
activity relationship (QSAR) modeling has emerged as a formidable alliance, enabling …

Pharmacometrics is a multidisciplinary field utilizing mathematical models of physiology,
pharmacology, and disease to describe and quantify the interactions between medication …

Nucleic acid nanoparticles, or NANPs, rationally designed to communicate with the human
immune system, can offer innovative therapeutic strategies to overcome the limitations of …

In silico ADMET models have progressed significantly over the past~ 4 decades, but still, the
pharmaceutical industry is vexed by the late-stage toxicity failure of lead molecules. This …

Several new viral infections have emerged in the human population and establishing as
global pandemics. With advancements in translation research, the scientific community has …

The recalcitrance of pathogens to traditional antibiotics has made treating and eradicating
bacterial infections more difficult. In this regard, developing new antimicrobial agents to …

Background: Blasting is commonly used for loosening hard rock during excavation for
generating the desired rock fragmentation required for optimizing the productivity of …

Drug discovery is an important domain of research for chemical scientists and
pharmaceutical industries. However, this process encompasses several challenges of …

In recent years, artificial intelligence (AI) has flourished in drug discovery and sped up the
process of drug research and development. Recently, it has been demonstrated that the …

Introduction Whereas in the past,(Q) SAR methods have been largely used to support the
design of new drugs, in the last few decades, there has been a new interest in its …