Avogadro (software)

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Avogadro
Avogadro Logo
Stable release 1.0.3 / April 25, 2011 (2011-04-25)[1]
Preview release 1.1.1 / December 11, 2013 (2013-12-11)[2]
Written in C++ (Qt)
Operating system Linux, Mac OS X, Microsoft Windows
License GNU General Public License
Website avogadro.cc

Avogadro (software) is a molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.[3][4][5][6] It is extensible through a plugin architecture.[7]

Features[edit]

Space-filling model of Loratadine created using Avogadro.

See also[edit]

External links[edit]

References[edit]

  1. ^ "Avogadro 1.0.3". April 24, 2011. Retrieved February 9, 2014. 
  2. ^ "Avogadro 1.1.1". December 11, 2013. Retrieved February 9, 2014. 
  3. ^ Hanwell, Marcus D; Curtis, Donald E; Lonie, David C; Vandermeersch, Tim; Zurek, Eva; Hutchison, Geoffrey R (2012). "Avogadro: An advanced semantic chemical editor, visualization, and analysis platform". J. Cheminform. 4 (1): 17. doi:10.1186/1758-2946-4-17. PMC 3542060. PMID 22889332. 
  4. ^ Ral Mera-Adasme; Fernando Mendizbal; Claudio Olea-Azar; Sebastin Miranda-Rojas; Patricio Fuentealba (2011). "A Computationally Efficient and Reliable Bond Order Measure". J. Phys. Chem. A 115 (17): 4397–4405. doi:10.1021/jp107498h. PMID 21469689. 
  5. ^ Michael Salciccioli; Weiting Yu; Mark A. Barteau; Jingguang G. Chen; Dionisios G. Vlachos (2011). "Differentiation of O–H and C–H Bond Scission Mechanisms of Ethylene Glycol on Pt and Ni/Pt Using Theory and Isotopic Labeling Experiments". J. Am. Chem. Soc. 133 (20): 7996–8004. doi:10.1021/ja201801t. PMID 21526776. 
  6. ^ Open Babel documentation Author: Geoffrey R Hutchison; Noel M O'Boyle; Blue Obelisk (Organization)
  7. ^ Avogadro home page