Chapter 3 introduces the important but obscure topic of enumerating molecules.
Enumeration means two things: first to list things separately, one by one and second to …

The first step in the process of drug development is to determine those lead compounds that
demonstrate significant biological activity with regard to a target protein. Because this …

Constant-isomer series are polycyclic aromatic hydrocarbon sets having equal numbers of
isomers. While presenting an overview of constant-isomer series, generalalgebraic …

A program has been designed which allows for the exhaustiveand nonredundant generation
and enumeration of organic compounds with cyclic, acyclic, and mixed structures which may …

An expert system for the elucidation of the structure of organic compounds (ESESOC) has
been developed. The heart of the ESESOC is formed by the structure generator as an …

A new method of structure generation, involving two steps, structure reduction and structure
assembly, is presented. The goal of structure reduction is to reduce the number of …

A new stereoisomer generation system named CAMGEC2 for generation of stereoisomers
containing isolated and spiro cycles with one or more descriptors among R, S, Z, E, M, and P …

Generation of organic stereoisomers with R/S, Z/E, and/or M/P configurations that may
contain heteroatoms, multiple bonds, and any kind of cycle (isolated, spiro, condensed, and …

This work, based on graph theory, presents a US-CAMGEC software developed for analysis,
generation, and counting organic unsaturated stereoisomers with isolated or cumulated …

Almost every chemical information system uses chemical structure handling. The exploration
of large data bases on chemical properties requires compact storage and fastsearch-ing of …