EuroMUG '02 -- 25 - 26 Sept, 2002

A Simple R-Group Analysis tool using Dayperl

David Nunn
Wyeth Research


A simple R-group analysis tool, written using DayPerl, will be presented. The system allows the input of a core structure and a list of SMILES. Output includes cannonical names for substituents attached to the core structure, and, optionally, simple calculated properties of the sidechains facilitating SAR analysis.

Presentation slides:

Daylight Chemical Information Systems, Inc.