Duct Tape and Super Glue

Introduction

The Three Virtues of a Great Programmer



Component Overview

Perl 5 and DayPerl

ChemDraw Plugin

MOLSMART

CACTVS

ChemDraw Plugin Structure Rendering

CACTVS Structure Rendering

DayCGI Structure Rendering



Application Examples

Reagent Selection

REOS Demo

REOS Input 1

REOS Input 2

REOS Progress

REOS Report Browser

REOS Structure View

REOS Property Tables

REOS Property Graphs



Library Enumeration

LIbGen Demo

The LibGen Main Screen

The Reaction Library

Library Submission

SMILES Output

Chemical Structure Output 1

Chemical Structure Output 2

REOS Library Input

Enumerating Large Libraries



Other Applications

Database Searching

LogPCalculator

Structure Browser

Structure Browser (with surface)

Conclusions

Caveat Emptor

Acknowledgments

Special Thanks

Extra Special Thanks