"Automated determination of chemical functionalisation addition routes ..."

Gregory Van Lier, Christopher P. Ewels, Paul Geerlings (2008)

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DOI: 10.1016/J.CPC.2008.01.030

access: closed

type: Journal Article

metadata version: 2023-09-30

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Gregory Van Lier, Christopher P. Ewels, Paul Geerlings:
Automated determination of chemical functionalisation addition routes based on magnetic susceptibility and nucleus independent chemical shifts. Comput. Phys. Commun. 179(1-3): 165-170 (2008)

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