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Article Dans Une Revue Computer Physics Communications Année : 2008

Automated determination of chemical functionalisation addition routes based on magnetic susceptibility and nucleus independent chemical shifts

G. van Lier
  • Fonction : Auteur
P. Geerlings
  • Fonction : Auteur

Dates et versions

hal-00396593 , version 1 (18-06-2009)

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G. van Lier, Christopher Ewels, P. Geerlings. Automated determination of chemical functionalisation addition routes based on magnetic susceptibility and nucleus independent chemical shifts. Computer Physics Communications, 2008, 179 (01-mars), pp.165. ⟨10.1016/j.cpc.2008.01.030⟩. ⟨hal-00396593⟩
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