In the early 1900s, Paul Ehrlich first defined pharmacophores as molecule frameworks that carry the essential features responsible for a drug's biological activ

Edited by world-famous pioneers in chemoinformatics, this is a clearly structured and applications-oriented approach to the topic, providing up-to-date and focu

30 tutorials and more than 100 exercises in chemoinformatics, supported by online software and data sets Chemoinformatics is widely used in both academic and in

This book aims to provide an introduction to the major techniques of chemoinformatics. It is the first text written specifically for this field. The first part

This book reviews the advances and challenges of structure-based drug design in the preclinical drug discovery process, addressing various diseases, including m