This volume presents a review of the latest numerical techniques used to
identify ligand binding and protein complexation sites. It should be
noted that there are many other theoretical studies devoted to
predicting the activity of specific proteins and that useful protein
data can be found in numerous databases. The aim of advanced
computational techniques is to identify the active sites in specific
proteins and moreover to suggest a generalized mechanism by which such
protein-ligand (or protein-protein) interactions can be effected.
Developing such tools is not an easy task - it requires extensive
expertise in the area of molecular biology as well as a firm grasp of
numerical modeling methods. Thus, it is often viewed as a prime
candidate for interdisciplinary research.