Web-based retrieval system for chemical structural formulas

• Main Author: Neo, Lok Tuan
• Other Authors: Hui Siu Cheung
• Format: Final Year Project
• Language: English
• Published: 2013
• Subjects: DRNTU::Engineering::Computer science and engineering::Information systems::Information storage and retrieval
• Online Access: http://hdl.handle.net/10356/55016
• Institution: Nanyang Technological University

The drug discovery process relies heavily on chemical substructure and similarity search results for lead identification. Researchers often pool substructure and similarity search results to obtain a larger set of lead molecules for drug suitability evaluation in subsequent stages of the drug discov...