IRIS publication 76416121
Confab - Systematic generation of diverse low-energy conformers.
RIS format for Endnote and similar
TY - JOUR - O'Boyle NM, Vandermeersch T, Flynn CJ, Maguire AR, Hutchison GR - 2011 - March - Journal of cheminformatics - Confab - Systematic generation of diverse low-energy conformers. - Validated - Altmetric: 4 () - 3 - 8 - 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 to a diversity criterion. - 1758-2946 - http://www.jcheminf.com/content/3/1/8 - 10.1186/1758-2946-3-8 DA - 2011/03 ER -
BIBTeX format for JabRef and similar
@article{V76416121, = {O'Boyle NM, Vandermeersch T and Flynn CJ, Maguire AR and Hutchison GR }, = {2011}, = {March}, = {Journal of cheminformatics}, = {Confab - Systematic generation of diverse low-energy conformers.}, = {Validated}, = {Altmetric: 4 ()}, = {3}, pages = {8}, = {{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 to a diversity criterion.}}, issn = {1758-2946}, = {http://www.jcheminf.com/content/3/1/8}, = {10.1186/1758-2946-3-8}, source = {IRIS} }
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AUTHORS | O'Boyle NM, Vandermeersch T, Flynn CJ, Maguire AR, Hutchison GR | ||
YEAR | 2011 | ||
MONTH | March | ||
JOURNAL_CODE | Journal of cheminformatics | ||
TITLE | Confab - Systematic generation of diverse low-energy conformers. | ||
STATUS | Validated | ||
TIMES_CITED | Altmetric: 4 () | ||
SEARCH_KEYWORD | |||
VOLUME | 3 | ||
ISSUE | |||
START_PAGE | 8 | ||
END_PAGE | |||
ABSTRACT | 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 to a diversity criterion. | ||
PUBLISHER_LOCATION | |||
ISBN_ISSN | 1758-2946 | ||
EDITION | |||
URL | http://www.jcheminf.com/content/3/1/8 | ||
DOI_LINK | 10.1186/1758-2946-3-8 | ||
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