| Literature DB >> 27485985 |
Abstract
This article is the text for a pedagogical lecture to be given at the Strasbourg Summer School in Chemoinformatics in June 2104. It covers a very wide range of reaction topics including structure and reaction representation, reaction centers, atom-to-atom mapping, reaction retrieval systems, computer-aided synthesis design, retrosynthesis, reaction prediction and synthetic feasibility. In the time available the coverage of each topic can only be cursory; the main usefulness of this article to the research community is the extensive bibliography.Keywords: Atom-to-atom mapping; Computer-aided synthesis design; Reaction prediction; Reaction retrieval systems; Synthetic feasibility
Year: 2014 PMID: 27485985 DOI: 10.1002/minf.201400052
Source DB: PubMed Journal: Mol Inform ISSN: 1868-1743 Impact factor: 3.353