Sampling and convergence in free energy calculations of protein-ligand interactions: The binding of triphenoxypyridine derivatives to factor Xa and trypsin

  1. Villa, A.
  2. Zangi, R.
  3. Pieffet, G.
  4. Mark, A.E.
Journal:
Journal of Computer-Aided Molecular Design

ISSN: 0920-654X

Year of publication: 2003

Volume: 17

Issue: 10

Pages: 673-686

Type: Article

DOI: 10.1023/B:JCAM.0000017374.53591.32 GOOGLE SCHOLAR

Sustainable development goals

Data source: Scopus