Introduction: Molecular topology (MT) has emerged in recent years as a powerful approach
for the in silico generation of new drugs. In the last decade, its application has become more …

Introduction Most methods in molecular and drug design are currently based on
physicochemical descriptors. However, molecular topology, which relies on topological …

BACKGROUND Quercetin (Que) has many pharmacological activities, such as anticancer,
antioxidant, cardiovascular protection, antihypertensive and lipid‐lowering activities …

Historically, identifying carcinogens has relied primarily on tumor studies in rodents, which
require enormous resources in both money and time. In silico models have been developed …

Sažetak This chapter reviews results of research carried out by Basak and collaborators
during the past four decades or so in the development of novel mathematical …

Osteosarcoma (OS) is the most common malignant tumor of bone with a high potential for
metastasis. This study intends to explore whether microRNA‐940 (miR‐940) affects the …

The control of antimicrobial resistance (AMR) seems to have come to an impasse. The use
and abuse of antibacterial drugs has had major consequences on the genetic mutability of …

Fungicide resistance is a major concern in modern agriculture; therefore, there is a pressing
demand to develop new, greener chemicals. Chitin is a major component of the fungal cell …

The aim of the present study is to show how molecular topology can be a powerful in silico
tool for the prediction of the fungicidal activity of several diphenylamine derivatives against …

The variability of methicillin-resistant Staphylococcus aureus (MRSA), its rapid adaptive
response against environmental changes, and its continued acquisition of antibiotic …