Confab - Systematic generation of diverse low-energy conformers

<p>Abstract</p> <p>Background</p> <p>Many computational chemistry analyses require the generation of conformers, either on-the-fly, or in advance. We present Confab, an open source command-line application for the systematic generation of low-energy conformers according...

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Bibliographic Details
Main Authors: O'Boyle Noel M, Vandermeersch Tim, Flynn Christopher J, Maguire Anita R, Hutchison Geoffrey R
Format: Article
Language:English
Published: BMC 2011-03-01
Series:Journal of Cheminformatics
Online Access:http://www.jcheminf.com/content/3/1/8