Download various files and programs supplementing this paper

  1. ISIS/Labjournal requires 4 files named
    lj_rxn.db
    lj_mol.db
    reagent.db
    solvent.db
    These files can be downloaded as one labjournal.zip file. However, both ISIS/Base and ISIS/Labjournal is required to use these files.
  2. In addition lj_rxn.db and lj_mol.db were exported as lj_rxn.rdf and lj_mol.rdf files respectively for download. These files can be used with ISIS/Base alone.
  3. For the calculation of aromatic shifts the BASIC program "NMR" [1] was used. This program can be downloaded together with the source code