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Issue 7, 2007
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Space group selection for crystal structure prediction of solvates

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Abstract

The most populated space groups for a selection of solvates of chiral and achiral molecules with common solvents are presented to assist crystal structure prediction calculations on these complex systems.

Graphical abstract: Space group selection for crystal structure prediction of solvates

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Publication details

The article was received on 09 Feb 2007, accepted on 14 Mar 2007 and first published on 23 Mar 2007


Article type: Paper
DOI: 10.1039/B702073B
Citation: CrystEngComm, 2007,9, 556-560
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    Space group selection for crystal structure prediction of solvates

    A. J. Cruz Cabeza, E. Pidcock, G. M. Day, W. D. S. Motherwell and W. Jones, CrystEngComm, 2007, 9, 556
    DOI: 10.1039/B702073B

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