Background: Chemical biology and chemogenomics are rapidly evolving disciplines at
interfaces between chemistry and the life sciences and are highly interdisciplinary in nature …

Pharmaceutical research and development (R&D) has faced outstanding challenges as
scientific breakthroughs achieved in the past two decades have revolutionized the field …

Chemoinformatics strategies to improve drug discovery results With contributions from
leading researchers in academia and the pharmaceutical industry as well as experts from …

Chemogenomics aims towards the systematic identification of small molecules that interact
with protein targets and modulate their function (Quinlan et al., 2021). This research field is a …

Paradigms in drug design and discovery are changing at a significant pace. Concomitant to
the sequencing of over 180 several genomes, the high‐throughput miniaturization of …

Abstract Preclinical Research The goal of chemogenomics is the exploration of all possible
interactions between compounds from the chemical space and targets from the biological …

This editorial introduces a new special focus issue dedicated to computational chemistry
and computer-aided drug discovery to be published in the third quarter of 2016, for which …

This book focuses on applications of compound library design and virtual screening to
expand the bioactive chemical space, to target hopping of chemotypes to identify synergies …

The first issue to be discussed is the definition of the topic. What is chemoinformatics and
why should you care? There is no clear definition, although a consensus view appears to be …

Recently, computational approaches have been considerably appreciated in drug discovery
and development. Their applications span almost all stages in the discovery and …