Molecular modeling study of dihydrofolate reductase inhibitors. Molecular dynamics simulations, quantum mechanical calculations, and experimental corroboration

  1. Tosso, R.D.
  2. Andujar, S.A.
  3. Gutierrez, L.
  4. Angelina, E.
  5. Rodríguez, R.
  6. Nogueras, M.
  7. Baldoni, H.
  8. Suvire, F.D.
  9. Cobo, J.
  10. Enriz, R.D.
Journal:
Journal of Chemical Information and Modeling

ISSN: 1549-9596 1520-5142

Year of publication: 2013

Volume: 53

Issue: 8

Pages: 2018-2032

Type: Article

DOI: 10.1021/CI400178H GOOGLE SCHOLAR