Machine learning methods such as neural networks, non-linear dimensionality reduction techniques, random forests and others meet in this research topic with bio

Designing molecules and materials with desired properties is an important prerequisite for advancing technology in our modern societies. This requires both the

Dr. Elif Ozkirimli is a full time employee of F. Hoffmann-La Roche AG, Switzerland and Dr. Artur Yakimovich is a full time employee of Roche Products Limited, U

A guide to applying the power of modern simulation tools to better drug design Biomolecular Simulations in Structure-based Drug Discovery offers an up-to-date a

Very broad overview of the field intended for an interdisciplinary audience; Lively discussion of current challenges written in a colloquial style; Author is a