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Issue 85, 2015
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Predicting solvent effects on the structure of porous organic molecules

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Abstract

A computational approach for the prediction of the open, metastable, conformations of porous organic molecules in the presence of solvent is developed.

Graphical abstract: Predicting solvent effects on the structure of porous organic molecules

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Publication details

The article was received on 29 Jun 2015, accepted on 28 Aug 2015 and first published on 02 Sep 2015


Article type: Communication
DOI: 10.1039/C5CC05344G
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Citation: Chem. Commun., 2015,51, 15542-15545
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    Predicting solvent effects on the structure of porous organic molecules

    V. Santolini, G. A. Tribello and K. E. Jelfs, Chem. Commun., 2015, 51, 15542
    DOI: 10.1039/C5CC05344G

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