Computer-Aided and Machine Learning-Driven Drug Design
Computer-Aided and Machine Learning-Driven Drug Design: From Theory to Applications
English | 2025 | ISBN: 3031767179 | 556 Pages | PDF EPUB (True) | 59 MB
English | 2025 | ISBN: 3031767179 | 556 Pages | PDF EPUB (True) | 59 MB
The computer-aided drug design research field comprises several different knowledge areas, and often, researchers are only familiar or experienced with a small fraction of them. Indeed, pharmaceutical industries and large academic groups rely on a broad range of professionals, including chemists, biologists, pharmacists, and computer scientists. In this sense, it is difficult to be an expert in every single CADD approach. Furthermore, there are well-established methods that are constantly revisited, and novel approaches are introduced, such as machine-learning based scoring functions for molecular docking.