An overview of the diversity represented in commercially-available databases Mary P. Bradley OriginalPaper Pages: 301 - 309
Filtering databases and chemical libraries Paul S. CharifsonW. Patrick Walters OriginalPaper Pages: 311 - 323
Current trends in lead discovery: Are we looking for the appropriate properties? Tudor I. Oprea OriginalPaper Pages: 325 - 334
Multiobjective optimization of combinatorial libraries D.K. Agrafiotis OriginalPaper Pages: 335 - 356
Predictive QSAR modeling based on diversity sampling of experimental datasets for the training and test set selection Alexander GolbraikhAlexander Tropsha OriginalPaper Pages: 357 - 369
Reactant- and product-based approaches to the design of combinatorial libraries Valerie J. Gillet OriginalPaper Pages: 371 - 380
Towards a new age of virtual ADME/TOX and multidimensional drug discovery Sean EkinsBruno BoulangerMaggie A.Z. Hupcey OriginalPaper Pages: 381 - 401
Exploring privileged structures: the combinatorial synthesis of cyclic peptides Douglas A. HortonGregory T. BourneMark L. Smythe OriginalPaper Pages: 415 - 431
Chemoinformatics methods for systematic comparison of molecules from natural and synthetic sources and design of hybrid libraries Jürgen Bajorath OriginalPaper Pages: 431 - 439
