What are the limits of applicability for graph theoretic descriptors in QSPR/QSAR? Modeling dipole moments of aromatic compounds with TOPS-MODE descriptors

  1. Estrada, E.
  2. González, H.
Journal:
Journal of Chemical Information and Computer Sciences

ISSN: 0095-2338

Year of publication: 2003

Volume: 43

Issue: 1

Pages: 75-84

Type: Article

DOI: 10.1021/CI025604W GOOGLE SCHOLAR