An overview of the diversity represented in commercially-available databases Mary P. Bradley OriginalPaper Pages: 175 - 183
Filtering databases and chemical libraries Paul S. CharifsonW. Patrick Walters OriginalPaper Pages: 185 - 197
Current trends in lead discovery: Are we looking for the appropriate properties? Tudor I. Oprea OriginalPaper Pages: 199 - 208
Multiobjective optimization of combinatorial libraries D.K. Agrafiotis OriginalPaper Pages: 209 - 230
Predictive QSAR modeling based on diversity sampling of experimental datasets for the training and test set selection Alexander GolbraikhAlexander Tropsha OriginalPaper Pages: 231 - 243
Reactant- and product-based approaches to the design of combinatorial libraries Valerie J. Gillet OriginalPaper Pages: 245 - 254
Towards a new age of virtual ADME/TOX and multidimensional drug discovery Sean EkinsBruno BoulangerMaggie A.Z. Hupcey OriginalPaper Pages: 255 - 275
Exploring privileged structures: The combinatorial synthesis of cyclic peptides Douglas A. HortonGregory T. BourneMark L. Smythe OriginalPaper Pages: 289 - 304
Chemoinformatics methods for systematic comparison of molecules from natural and synthetic sources and design of hybrid libraries Jürgen Bajorath OriginalPaper Pages: 305 - 313
