Application of chemoinformatics to high-throughput screening: practical considerations

Methods Mol Biol. 2004:275:85-110. doi: 10.1385/1-59259-802-1:085.

Abstract

The objective of this chapter is to summarize and evaluate some of the most common chemoinformatic methods that are applied to the analysis of high-throughput-screening data. The chapter will briefly describe current high-throughput-screening practices and will stress how the major constraint on the application of chemoinformatics is often the quality of high-throughput-screening data. Discussion of the NCI dataset and how it differs from most high-throughput-screening datasets will be made to highlight this point.

Publication types

  • Review

MeSH terms

  • Chemical Phenomena
  • Chemistry*
  • Information Services*
  • National Institutes of Health (U.S.)
  • United States