The recently reported geometrical algorithm to search the conformational space (GASCOS)
scans conformational space exhaustively using an internal coordinate tree search. Using …

We have reported a systematic search method, GASCOS, for open chain compounds. An
extension to cyclic structures was recently reported. In this paper, we propose a more …

The coupling of conformation to activity and reactivity is a widely accepted concept, and as
such has driven the development of tools which execute conformational searches in rapid …

A new method for searching internal coordinate conformational space systematically via a
continuous‐process procedure is described. Unlike previous systematic search methods …

A general algorithm is described which exhaustively searches conformational space using
an internal coordinate tree search. Using only geometrical operations and a set of criteria for …

A new conformational search program, HUNTER, connected with the force fields MMP2 and
MM3 (92) is presented. The program accepts all types of molecules with most different …

Modifications to the distance geometry algorithm as embodied in the program DGEOM have
been made to improve sampling capabilities. Specifically, torsion angle sampling replaces …

Several methods are available in the literature for the conformational analysis of small
molecules. Each of these methods has some advantages and some disadvantages. Also …

A new approach for coverage of the conformational space by a limited number of conformers
is proposed. Instead of using a systematic search whose time complexity increases …

This chapter contains sections titled: Introduction Systematic Search Methods Model
Building Approaches and Symbolic Representations of Conformation Random Search …