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Topology dictionary (topoCIF) version 0.9.1

_topol_repres_node.structural_formula_InChI

Name:
'_topol_repres_node.structural_formula_InChI'

Definition:

   

     Formula of the residue or ion which corresponds to the node.
     The formula is written in accordance with the rules for IUPAC
     international chemical identifiers (InChI) as described
     by Heller et al. (2015).

     Reference: Heller, S. R., McNaught, A., Pletnev, I. &
     Tchekhovskoi, D. (2015). J. Cheminformat. 7:23,
     DOI:10.1186/s13321-015-0068-4.


Type: Text

Category: topol_repres_node