MUG '03 -- 25 - 28 Feb, 2003

Yet Another Enumeration Tool

Atipat Rojnuckarin
ArQule

ABSTRACT

This talk describes the ongoing challenges of building an enumeration component that:

The current version of the component is written as a C++ class library using the Daylight reaction Toolkit. Reaction schemes, transformations and reagent structures are extracted from an Oracle database. A web-based user-interface assists users in entering transformations, reaction schemes and reagents, and in inspecting enumerated structures.

Presentation slides:


Daylight Chemical Information Systems, Inc.
info@daylight.com