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<i>Mercury CSD 2.0</i>– new features for the visualization and investigation of crystal structures

Clare F. Macrae; Ian Bruno; James A. Chisholm; Paul R. Edgington; Patrick McCabe; Elna Pidcock; Lucía Rodríguez-Monge; Robin Taylor · Journal of Applied Crystallography · 2008

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Author / responsible party
Clare F. Macrae; Ian Bruno; James A. Chisholm; Paul R. Edgington; Patrick McCabe; Elna Pidcock; Lucía Rodríguez-Monge; Robin Taylor
Publisher
Journal of Applied Crystallography
Year
2008
Language
English

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The program Mercury , developed by the Cambridge Crystallographic Data Centre, is designed primarily as a crystal structure visualization tool. A new module of functionality has been produced, called the Materials Module , which allows highly customizable searching of structural databases for intermolecular interaction motifs and packing patterns. This new module also includes the ability to perform packing similarity calculations between structures containing the same compound. In addition to the Materials Module , a range of further enhancements to Mercury has been added in this latest release, including void visualization and links to ConQuest , Mogul and IsoStar .

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APA 7

Macrae, C. F, Bruno, I, Chisholm, J. A, Edgington, P. R, McCabe, P, Pidcock, E, Rodríguez-Monge, L, & Taylor, R. (2008). Mercury CSD 2.0– new features for the visualization and investigation of crystal structures. https://doi.org/10.1107/s0021889807067908

MLA

Macrae, Clare F, et al. "Mercury CSD 2.0– new features for the visualization and investigation of crystal structures." 2008. https://doi.org/10.1107/s0021889807067908.

Chicago

Macrae, Clare F, Ian Bruno, James A. Chisholm, Paul R. Edgington, Patrick McCabe, Elna Pidcock, Lucía Rodríguez-Monge, and Robin Taylor. 2008. "Mercury CSD 2.0– new features for the visualization and investigation of crystal structures.". https://doi.org/10.1107/s0021889807067908.

Harvard

Macrae, C. F. et al. 2008, Mercury CSD 2.0– new features for the visualization and investigation of crystal structures, Journal of Applied Crystallography, available at: https://doi.org/10.1107/s0021889807067908 [Accessed 7 Aug. 2026].

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Title
<i>Mercury CSD 2.0</i>– new features for the visualization and investigation of crystal structures
Author / contributors
Clare F. Macrae; Ian Bruno; James A. Chisholm; Paul R. Edgington; Patrick McCabe; Elna Pidcock; Lucía Rodríguez-Monge; Robin Taylor
Publisher
Journal of Applied Crystallography
Publication year
2008
Language
English

Subjects

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Visualization; Mercury (programming language); Crystal structure; Void (composites); Intermolecular force; Computer science; Materials science; Crystallography; Nanotechnology; Chemistry; Molecule; Data mining
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