Article ID Journal Published Year Pages File Type
5394236 Computational and Theoretical Chemistry 2013 14 Pages PDF
Abstract
► Computational design of functionalized single walled carbon nanotubes. ► DFT based estimation of proton affinity of amino acid sidechain analogues. ► Attachment to CNT wall markedly affects proton affinities in gas and solution phases.
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Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
Proton affinity of polar amino acid sidechain analogues anchored to the outer wall of single walled carbon nanotubes
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